Compile Data Set for Download or QSAR
Report error Found 112 Enz. Inhib. hit(s) with all data for entry = 50037288
TargetAcetylcholinesterase(Electric eel)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50102738(CHEMBL1204162 | CHEMBL281799 | [2-(1-Benzyl-piperi...)
Affinity DataIC50: 10nMAssay Description:Inhibitory concentration towards acetylcholinesterase in electric eelMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetAcetylcholinesterase(Electric eel)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50074277(CHEMBL25412 | [2-(1-Benzyl-piperidin-4-yl)-ethyl]-...)
Affinity DataIC50: 120nMAssay Description:Inhibitory concentration towards acetylcholinesterase in electric eelMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetPotassium voltage-gated channel subfamily KQT member 1(Guinea pig)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50099582(N-[(3R,4S)-3-Hydroxy-2,2-dimethyl-6-(4,4,4-trifluo...)
Affinity DataIC50: 120nMAssay Description:Inhibition of guinea pig Iks potassium channel expressed in Xenopus oocytesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetEndothelin-1 receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50034435(BMS-182874 | 5-Dimethylamino-naphthalene-1-sulfoni...)
Affinity DataIC50: 150nMAssay Description:Inhibitory concentration against Endothelin A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetEndothelin-1 receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50034452(CHEMBL453 | Gantrisin | Sosol | Sulfalar | Eryzole...)
Affinity DataIC50: 780nMAssay Description:Inhibitory concentration against Endothelin A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetAcetylcholinesterase(Electric eel)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50074276(CHEMBL541350 | CHEMBL25264 | [4-(3,4-Dihydro-1H-is...)
Affinity DataIC50: 1.90E+3nMAssay Description:Inhibitory concentration towards acetylcholinesterase in electric eelMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetPotassium voltage-gated channel subfamily KQT member 1(Guinea pig)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50106227((3R,4S)-Ethanesulfonic acid (6-cyano-3-hydroxy-2,2...)
Affinity DataIC50: 5.00E+3nMAssay Description:Inhibition of guinea pig Iks potassium channel expressed in Xenopus oocytesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetPotassium voltage-gated channel subfamily KQT member 1(Guinea pig)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50099567(Ethanesulfonic acid (6-cyano-3-hydroxy-2,2-dimethy...)
Affinity DataIC50: 6.20E+3nMAssay Description:Inhibition of guinea pig Iks potassium channel expressed in Xenopus oocytesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetAcetylcholinesterase(Electric eel)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50074265(CHEMBL281588 | CHEMBL538098 | (6-Phenyl-pyridazin-...)
Affinity DataIC50: 1.30E+4nMAssay Description:Inhibitory concentration towards acetylcholinesterase in electric eelMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetPotassium voltage-gated channel subfamily KQT member 1(Guinea pig)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50099567(Ethanesulfonic acid (6-cyano-3-hydroxy-2,2-dimethy...)
Affinity DataIC50: 3.90E+4nMAssay Description:Inhibition of guinea pig Iks potassium channel expressed in Xenopus oocytesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetEndothelin-1 receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50027796(2-Sulfanilamidothiazole | 2-(p-Aminobenzenesulphon...)
Affinity DataIC50: 6.90E+4nMAssay Description:Inhibitory concentration against Endothelin A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetAcetylcholinesterase(Electric eel)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50074289(CHEMBL536932 | CHEMBL278819 | (4-Methyl-6-phenyl-p...)
Affinity DataIC50: 6.00E+5nMAssay Description:Inhibitory concentration towards acetylcholinesterase in electric eelMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetEndothelin-1 receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50140757(BMS-207940 | N-[2'-(3,4-Dimethyl-isoxazol-5-ylsulf...)
Affinity DataKi:  0.0100nMAssay Description:Inhibitory concentration against Endothelin A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetD(3) dopamine receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50133923(4-Cyano-1-methoxy-naphthalene-2-carboxylic acid (1...)
Affinity DataKi:  0.110nMAssay Description:Binding affinity against Dopamine receptor D3More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetAlpha-1A adrenergic receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50453799(Niguldipine)
Affinity DataKi:  0.160nMAssay Description:Binding affinity towards recombinant human alpha-1A adrenergic receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2A(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50001885(3-{2-[4-(6-Fluoro-benzo[d]isoxazol-3-yl)-piperidin...)
Affinity DataKi:  0.160nMAssay Description:Binding affinity towards human serotonin 5-hydroxytryptamine 2A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2A(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50048803(5-[2-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-et...)
Affinity DataKi:  0.300nMAssay Description:Binding affinity towards human serotonin 5-hydroxytryptamine 2A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetAlpha-1A adrenergic receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50140762(4-((S)-3,4-Difluoro-phenyl)-2-methoxymethyl-6-oxo-...)
Affinity DataKi:  0.360nMAssay Description:Binding affinity towards recombinant human alpha-1A adrenergic receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2A(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50001786(1-[2-[4-[5-chloro-1-(4-fluorophenyl)-indol-3-yl]-1...)
Affinity DataKi:  0.850nMAssay Description:Binding affinity towards human serotonin 5-hydroxytryptamine 2A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2A(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM35255(2-Chloro-11-(2-(dimethylamino)ethoxy)dibenzo(b,f)t...)
Affinity DataKi:  0.910nMAssay Description:Binding affinity towards human serotonin 5-hydroxytryptamine 2A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2C(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50001786(1-[2-[4-[5-chloro-1-(4-fluorophenyl)-indol-3-yl]-1...)
Affinity DataKi:  1.30nMAssay Description:Binding affinity towards human serotonin 5-hydroxytryptamine 2C receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetEndothelin-1 receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50091105(4'-Oxazol-2-yl-biphenyl-2-sulfonicacid(3,4-dimethy...)
Affinity DataKi:  1.40nMAssay Description:Inhibitory concentration against Endothelin A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetD(2) dopamine receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM21398(4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...)
Affinity DataKi:  1.40nMAssay Description:Binding affinity towards human Dopamine receptor D2More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetAlpha-1A/Alpha-1B/Alpha-1D adrenergic receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50001786(1-[2-[4-[5-chloro-1-(4-fluorophenyl)-indol-3-yl]-1...)
Affinity DataKi:  1.80nMAssay Description:Binding affinity towards human alpha-1 adrenergic receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2A(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM35254(CHEMBL715 | 2-methyl-4-(4-methylpiperazin-1-yl)-10...)
Affinity DataKi:  1.90nMAssay Description:Binding affinity towards human serotonin 5-hydroxytryptamine 2A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetD(4) dopamine receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50140755(N-(1-Benzyl-pyrrolidin-3-yl)-5-chloro-4-(cycloprop...)
Affinity DataKi:  2.10nMAssay Description:Binding affinity towards human Dopamine receptor D4More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetHistamine H1 receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50001884(8-Chloro-11-(4-methyl-piperazin-1-yl)-5H-dibenzo[b...)
Affinity DataKi:  2.10nMAssay Description:Binding affinity towards human histamine H1 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetAlpha-1A/Alpha-1B/Alpha-1D adrenergic receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50001885(3-{2-[4-(6-Fluoro-benzo[d]isoxazol-3-yl)-piperidin...)
Affinity DataKi:  2.30nMAssay Description:Binding affinity towards human alpha-1 adrenergic receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetHistamine H1 receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50001885(3-{2-[4-(6-Fluoro-benzo[d]isoxazol-3-yl)-piperidin...)
Affinity DataKi:  2.60nMAssay Description:Binding affinity towards human histamine H1 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2C(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM35255(2-Chloro-11-(2-(dimethylamino)ethoxy)dibenzo(b,f)t...)
Affinity DataKi:  2.90nMAssay Description:Binding affinity towards human serotonin 5-hydroxytryptamine 2C receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetMuscarinic acetylcholine receptor M1(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50140751(2-{6-[2-(8-Aza-bicyclo[3.2.1]oct-8-yl)-ethylamino]...)
Affinity DataKi:  3nMAssay Description:Binding affinity towards muscarinic M1 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetD(2) dopamine receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50001885(3-{2-[4-(6-Fluoro-benzo[d]isoxazol-3-yl)-piperidin...)
Affinity DataKi:  3.30nMAssay Description:Binding affinity towards human Dopamine receptor D2More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2A(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50001884(8-Chloro-11-(4-methyl-piperazin-1-yl)-5H-dibenzo[b...)
Affinity DataKi:  3.30nMAssay Description:Binding affinity towards human serotonin 5-hydroxytryptamine 2A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetAlpha-1A/Alpha-1B/Alpha-1D adrenergic receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM35255(2-Chloro-11-(2-(dimethylamino)ethoxy)dibenzo(b,f)t...)
Affinity DataKi:  3.40nMAssay Description:Binding affinity towards human alpha-1 adrenergic receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetHistamine H1 receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM35255(2-Chloro-11-(2-(dimethylamino)ethoxy)dibenzo(b,f)t...)
Affinity DataKi:  3.40nMAssay Description:Binding affinity towards human histamine H1 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetHistamine H1 receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM35254(CHEMBL715 | 2-methyl-4-(4-methylpiperazin-1-yl)-10...)
Affinity DataKi:  3.5nMAssay Description:Binding affinity towards human histamine H1 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
LigandPNGBDBM50453799(Niguldipine)
Affinity DataKi:  4.60nMAssay Description:Binding affinity for rat L-type [Ca2+] channelMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetHistamine H1 receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50048803(5-[2-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-et...)
Affinity DataKi:  5.30nMAssay Description:Binding affinity towards human histamine H1 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetD(1B) dopamine receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50140768(5-Chloro-4-(cyclopropanecarbonyl-amino)-2-methoxy-...)
Affinity DataKi:  5.60nMAssay Description:Binding affinity against human Dopamine receptor D4 versus hD2, hD3 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetEndothelin-1 receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50050794(2-(4,6-Dimethoxy-pyrimidin-2-yloxy)-3-methoxy-3,3-...)
Affinity DataKi:  6nMAssay Description:Binding affinity against human Endothelin A receptor; orally active in vivo at 30 mg/kg, poMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2C(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM35254(CHEMBL715 | 2-methyl-4-(4-methylpiperazin-1-yl)-10...)
Affinity DataKi:  7.10nMAssay Description:Binding affinity towards human serotonin 5-hydroxytryptamine 2C receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetD(2) dopamine receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50001786(1-[2-[4-[5-chloro-1-(4-fluorophenyl)-indol-3-yl]-1...)
Affinity DataKi:  7.40nMAssay Description:Binding affinity towards human Dopamine receptor D2More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetAlpha-2A/Alpha-2B/Alpha-2C adrenergic receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50001885(3-{2-[4-(6-Fluoro-benzo[d]isoxazol-3-yl)-piperidin...)
Affinity DataKi:  7.5nMAssay Description:Binding affinity towards human alpha-2 adrenergic receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetD(3) dopamine receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50048803(5-[2-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-et...)
Affinity DataKi:  7.5nMAssay Description:Binding affinity towards human Dopamine receptor D3More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetD(3) dopamine receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50001786(1-[2-[4-[5-chloro-1-(4-fluorophenyl)-indol-3-yl]-1...)
Affinity DataKi:  8.20nMAssay Description:Binding affinity towards human Dopamine receptor D3More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetD(2) dopamine receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50048803(5-[2-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-et...)
Affinity DataKi:  9.70nMAssay Description:Binding affinity towards human Dopamine receptor D2More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetD(4) dopamine receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM21398(4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...)
Affinity DataKi:  11nMAssay Description:Binding affinity towards human Dopamine receptor D4More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetAlpha-1A/Alpha-1B/Alpha-1D adrenergic receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50048803(5-[2-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-et...)
Affinity DataKi:  12nMAssay Description:Binding affinity towards human alpha-1 adrenergic receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetD(2) dopamine receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM35255(2-Chloro-11-(2-(dimethylamino)ethoxy)dibenzo(b,f)t...)
Affinity DataKi:  13nMAssay Description:Binding affinity towards human Dopamine receptor D2More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetD(3) dopamine receptor(Human)
Prestwick Chemical

Curated by ChEMBL
LigandPNGBDBM50001885(3-{2-[4-(6-Fluoro-benzo[d]isoxazol-3-yl)-piperidin...)
Affinity DataKi:  13nMAssay Description:Binding affinity towards human Dopamine receptor D3More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
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