BDBM50154844 CHEMBL3775197::US10273244, Example 147::US10584135, Example 147

SMILES Cn1c(SCCCN2CC3CCN(C3C2)c2ccccc2C(F)(F)F)nnc1-c1cccnc1

InChI Key InChIKey=UFUQIVBOXLXINJ-UHFFFAOYSA-N

Data  12 KI  8 IC50

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 20 hits for monomerid = 50154844   

TargetD(3) dopamine receptor(Human)
Aptuit

Curated by ChEMBL

LigandBDBM50154844(CHEMBL3775197 | US10273244, Example 147 | US105841...)Copy SMILESCopy InChI

Affinity DataKi:  3.98nMAssay Description:Displacement of [3H]-spiperone from human dopamine D3 receptor expressed in CHO-K1 cell membranes after 90 mins by liquid scintillation counter metho...More data for this Ligand-Target Pair

Target InfoPDB
UniProtKB/SwissProt
GoogleScholar

Ligand InfoCHEMBLPC cidPC sidSimilars

In Depth
Date in BDB:
7/8/2017
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TargetD(3) dopamine receptor(Human)
Aptuit

Curated by ChEMBL

LigandBDBM50154844(CHEMBL3775197 | US10273244, Example 147 | US105841...)Copy SMILESCopy InChI

Affinity DataKi:  9.77nMAssay Description:[3H]-Spiperone Binding Assay at hD3 and hD4 recombinant receptors CHO cells transiently transfected with human dopamine type 3 or 4 receptors (CHO-hD...More data for this Ligand-Target Pair

Target InfoPDB
UniProtKB/SwissProt
GoogleScholar

Ligand InfoCHEMBLPC cidPC sidSimilars

In Depth
Date in BDB:
11/29/2020
Entry Details
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TargetD(3) dopamine receptor(Human)
Aptuit

Curated by ChEMBL

LigandBDBM50154844(CHEMBL3775197 | US10273244, Example 147 | US105841...)Copy SMILESCopy InChI

Affinity DataKi:  9.77nMAssay Description:3H]-Spiperone Binding Assay at hD3 and hD4 recombinant receptors CHO cells transiently transfected with human dopamine type 3 or 4 receptors (CHO-hD3...More data for this Ligand-Target Pair

Target InfoPDB
UniProtKB/SwissProt
GoogleScholar

Ligand InfoCHEMBLPC cidPC sidSimilars

In Depth
Date in BDB:
2/20/2020
Entry Details
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TargetD(3) dopamine receptor(Human)
Aptuit

Curated by ChEMBL

LigandBDBM50154844(CHEMBL3775197 | US10273244, Example 147 | US105841...)Copy SMILESCopy InChI

Affinity DataKi:  50nMAssay Description:Displacement of [3H]-spiperone from human dopamine D3 receptor expressed in CHO-K1 cell membranes after 90 mins by liquid scintillation counter metho...More data for this Ligand-Target Pair

Target InfoPDB
UniProtKB/SwissProt
GoogleScholar

Ligand InfoCHEMBLPC cidPC sidSimilars

In Depth
Date in BDB:
7/8/2017
Entry Details Article
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TargetD(3) dopamine receptor(Human)
Aptuit

Curated by ChEMBL

LigandBDBM50154844(CHEMBL3775197 | US10273244, Example 147 | US105841...)Copy SMILESCopy InChI

Affinity DataKi:  50.1nMAssay Description:Displacement of [3H]-spiperone from human dopamine D3 receptor expressed in CHO-K1 cell membranes after 90 mins by liquid scintillation counter metho...More data for this Ligand-Target Pair

Target InfoPDB
UniProtKB/SwissProt
GoogleScholar

Ligand InfoCHEMBLPC cidPC sidSimilars

In Depth
Date in BDB:
7/8/2017
Entry Details Article
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TargetD(2) dopamine receptor(Human)
Aptuit

Curated by ChEMBL

LigandBDBM50154844(CHEMBL3775197 | US10273244, Example 147 | US105841...)Copy SMILESCopy InChI

Affinity DataKi:  398nMAssay Description:Displacement of [3H]-spiperone from human dopamine D2 receptor expressed in CHO-K1 cell membranes after 120 mins by liquid scintillation counter meth...More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProtUniProtKB/TrEMBL
GoogleScholar

Ligand InfoCHEMBLPC cidPC sidSimilars

In Depth
Date in BDB:
7/8/2017
Entry Details Article
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TargetMuscarinic acetylcholine receptor M1(Human)
Aptuit

Curated by ChEMBL

LigandBDBM50154844(CHEMBL3775197 | US10273244, Example 147 | US105841...)Copy SMILESCopy InChI

Affinity DataKi:  631nMAssay Description:Antagonist activity at recombinant human muscarinic M1 receptor expressed in CHO-K1 cells assessed as inhibition of acetylcholine induced calcium mob...More data for this Ligand-Target Pair

Target InfoPDB
UniProtKB/SwissProt
GoogleScholar

Ligand InfoCHEMBLPC cidPC sidSimilars

In Depth
Date in BDB:
7/8/2017
Entry Details Article
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TargetD(2) dopamine receptor(Human)
Aptuit

Curated by ChEMBL

LigandBDBM50154844(CHEMBL3775197 | US10273244, Example 147 | US105841...)Copy SMILESCopy InChI

Affinity DataKi:  724nMAssay Description:CHO cells stably expressing human dopamine receptor type 2, long variant (hD2L), coupled to Gα16 protein (CHO-Gα16-hD2L) were re-suspended ...More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProtUniProtKB/TrEMBL
GoogleScholar

Ligand InfoCHEMBLPC cidPC sidSimilars

In Depth
Date in BDB:
11/29/2020
Entry Details
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TargetD(2) dopamine receptor(Human)
Aptuit

Curated by ChEMBL

LigandBDBM50154844(CHEMBL3775197 | US10273244, Example 147 | US105841...)Copy SMILESCopy InChI

Affinity DataKi:  724nMAssay Description:Functional Calcium Assay at hD2 recombinant receptor. CHO cells stably expressing human dopamine receptor type 2, long variant (hD2L), coupled to G&#...More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProtUniProtKB/TrEMBL
GoogleScholar

Ligand InfoCHEMBLPC cidPC sidSimilars

In Depth
Date in BDB:
2/20/2020
Entry Details
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TargetCytochrome P450 3A4(Human)
Aptuit

Curated by ChEMBL

LigandBDBM50154844(CHEMBL3775197 | US10273244, Example 147 | US105841...)Copy SMILESCopy InChI

Affinity DataIC50: 920nMAssay Description:Inhibition of recombinant human CYP3A4 expressed in baculosomes preincubated for 10 mins followed by cofactor addition measured every minute for 10 m...More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProtUniProtKB/TrEMBL
GoogleScholar

Ligand InfoCHEMBLPC cidPC sidSimilars

In Depth
Date in BDB:
7/8/2017
Entry Details Article
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TargetD(2) dopamine receptor(Human)
Aptuit

Curated by ChEMBL

LigandBDBM50154844(CHEMBL3775197 | US10273244, Example 147 | US105841...)Copy SMILESCopy InChI

Affinity DataKi:  1.25E+3nMAssay Description:Displacement of [3H]-spiperone from human dopamine D2 receptor expressed in CHO-K1 cell membranes after 120 mins by liquid scintillation counter meth...More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProtUniProtKB/TrEMBL
GoogleScholar

Ligand InfoCHEMBLPC cidPC sidSimilars

In Depth
Date in BDB:
7/8/2017
Entry Details Article
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TargetD(2) dopamine receptor(Human)
Aptuit

Curated by ChEMBL

LigandBDBM50154844(CHEMBL3775197 | US10273244, Example 147 | US105841...)Copy SMILESCopy InChI

Affinity DataKi:  1.26E+3nMAssay Description:Displacement of [3H]-spiperone from human dopamine D2 receptor expressed in CHO-K1 cell membranes after 120 mins by liquid scintillation counter meth...More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProtUniProtKB/TrEMBL
GoogleScholar

Ligand InfoCHEMBLPC cidPC sidSimilars

In Depth
Date in BDB:
7/8/2017
Entry Details Article
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TargetPotassium voltage-gated channel subfamily H member 2(Human)
Aptuit

Curated by ChEMBL

LigandBDBM50154844(CHEMBL3775197 | US10273244, Example 147 | US105841...)Copy SMILESCopy InChI

Affinity DataIC50: 1.99E+3nMAssay Description:Inhibition of human ERG tail current expressed in HEK293 cells after 5 mins by patch clamp assayMore data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProtUniProtKB/TrEMBL
GoogleScholar

Ligand InfoCHEMBLPC cidPC sidSimilars

In Depth
Date in BDB:
7/8/2017
Entry Details Article
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TargetPotassium voltage-gated channel subfamily H member 2(Human)
Aptuit

Curated by ChEMBL

LigandBDBM50154844(CHEMBL3775197 | US10273244, Example 147 | US105841...)Copy SMILESCopy InChI

Affinity DataIC50: 2.00E+3nMAssay Description:Inhibition of human ERG tail current expressed in HEK293 cells after 5 mins by patch clamp assayMore data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProtUniProtKB/TrEMBL
GoogleScholar

Ligand InfoCHEMBLPC cidPC sidSimilars

In Depth
Date in BDB:
7/8/2017
Entry Details Article
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TargetMuscarinic acetylcholine receptor M3(Human)
Aptuit

Curated by ChEMBL

LigandBDBM50154844(CHEMBL3775197 | US10273244, Example 147 | US105841...)Copy SMILESCopy InChI

Affinity DataKi:  2.19E+3nMAssay Description:Antagonist activity at recombinant human muscarinic M3 receptor expressed in CHO-K1 cells assessed as inhibition of acetylcholine induced calcium mob...More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoCHEMBLPC cidPC sidSimilars

In Depth
Date in BDB:
7/8/2017
Entry Details Article
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TargetCytochrome P450 1A2(Human)
Aptuit

Curated by ChEMBL

LigandBDBM50154844(CHEMBL3775197 | US10273244, Example 147 | US105841...)Copy SMILESCopy InChI

Affinity DataIC50: 3.00E+3nMAssay Description:Inhibition of recombinant human CYP1A2 expressed in baculosomes preincubated for 10 mins followed by cofactor addition measured every minute for 10 m...More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoCHEMBLPC cidPC sidSimilars

In Depth
Date in BDB:
7/8/2017
Entry Details Article
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TargetCytochrome P450 2C9(Human)
Aptuit

Curated by ChEMBL

LigandBDBM50154844(CHEMBL3775197 | US10273244, Example 147 | US105841...)Copy SMILESCopy InChI

Affinity DataIC50: 3.00E+3nMAssay Description:Inhibition of recombinant human CYP2C9 expressed in baculosomes preincubated for 10 mins followed by cofactor addition measured every minute for 10 m...More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoCHEMBLPC cidPC sidSimilars

In Depth
Date in BDB:
7/8/2017
Entry Details Article
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TargetCytochrome P450 3A4(Human)
Aptuit

Curated by ChEMBL

LigandBDBM50154844(CHEMBL3775197 | US10273244, Example 147 | US105841...)Copy SMILESCopy InChI

Affinity DataIC50: 3.00E+3nMAssay Description:Inhibition of recombinant human CYP3A4 expressed in baculosomes preincubated for 10 mins followed by cofactor addition measured every minute for 10 m...More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProtUniProtKB/TrEMBL
GoogleScholar

Ligand InfoCHEMBLPC cidPC sidSimilars

In Depth
Date in BDB:
7/8/2017
Entry Details Article
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TargetCytochrome P450 2C19(Human)
Aptuit

Curated by ChEMBL

LigandBDBM50154844(CHEMBL3775197 | US10273244, Example 147 | US105841...)Copy SMILESCopy InChI

Affinity DataIC50: 3.00E+3nMAssay Description:Inhibition of recombinant human CYP2C19 expressed in baculosomes preincubated for 10 mins followed by cofactor addition measured every minute for 10 ...More data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProt
GoogleScholar

Ligand InfoCHEMBLPC cidPC sidSimilars

In Depth
Date in BDB:
7/8/2017
Entry Details Article
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TargetCytochrome P450 2D6(Human)
Aptuit

Curated by ChEMBL

LigandBDBM50154844(CHEMBL3775197 | US10273244, Example 147 | US105841...)Copy SMILESCopy InChI

Affinity DataIC50: 3.00E+3nMAssay Description:Inhibition of recombinant human CYP2D6 expressed in baculosomes preincubated for 10 mins followed by cofactor addition measured every minute for 10 m...More data for this Ligand-Target Pair

Target InfoPDB
UniProtKB/SwissProtUniProtKB/TrEMBL
GoogleScholar

Ligand InfoCHEMBLPC cidPC sidSimilars

In Depth
Date in BDB:
7/8/2017
Entry Details Article
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