BDBM36898 MLS000078404::SMR000040621::[4-(8-bromanyl-5H-pyrimido[5,4-b]indol-4-yl)piperazin-1-yl]-(furan-2-yl)methanone::[4-(8-bromo-5H-pyrimid[5,4-b]indol-4-yl)piperazino]-(2-furyl)methanone::[4-(8-bromo-5H-pyrimido[5,4-b]indol-4-yl)-1-piperazinyl]-(2-furanyl)methanone::[4-(8-bromo-5H-pyrimido[5,4-b]indol-4-yl)piperazin-1-yl]-(furan-2-yl)methanone::cid_659580

SMILES Brc1ccc2[nH]c3c(ncnc3c2c1)N1CCN(CC1)C(=O)c1ccco1

InChI Key InChIKey=YMXKKZXNMOGQGM-UHFFFAOYSA-N

Data  2 IC50  3 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 36898   

TargetSphingosine 1-phosphate receptor 1(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM36898(MLS000078404 | [4-(8-bromo-5H-pyrimido[5,4-b]indol...)
Affinity DataEC50: >1.00E+4nMAssay Description:Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/28/2011
Entry Details
PCBioAssay
TargetSphingosine 1-phosphate receptor 1(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM36898(MLS000078404 | [4-(8-bromo-5H-pyrimido[5,4-b]indol...)
Affinity DataEC50:  1.39E+4nMAssay Description:Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/29/2011
Entry Details
PCBioAssay
TargetSphingosine 1-phosphate receptor 1(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM36898(MLS000078404 | [4-(8-bromo-5H-pyrimido[5,4-b]indol...)
Affinity DataEC50:  1.55E+4nMAssay Description:Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/28/2011
Entry Details
PCBioAssay
TargetSignal transducer and activator of transcription 1-alpha/beta(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM36898(MLS000078404 | [4-(8-bromo-5H-pyrimido[5,4-b]indol...)
Affinity DataIC50: 2.36E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute (TSRI) Assay...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/21/2011
Entry Details
PCBioAssay
TargetSignal transducer and activator of transcription 3 [702-738,740-752](Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM36898(MLS000078404 | [4-(8-bromo-5H-pyrimido[5,4-b]indol...)
Affinity DataIC50: 2.56E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute (TSRI) Assay...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/28/2011
Entry Details
PCBioAssay