Brief Information of the Compound and Protein
Compound Name
(5H,11H-benzo[e]pyrrolo[1,2-a][1,4]diazepin-10-yl)-[2-chloro-4-(3-methyl-pyrazol-1-yl)-phenyl]-methanone
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PubChem ID
CID: 5311500
SID: 12015369
Canonical SMILES
Cc1ccn(n1)-c1ccc(C(=O)N2Cc3cccn3Cc3ccccc23)c(Cl)c1
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Compound Formula C23H19ClN4O
Compound Structure
Protein Name
Vasopressin V1a receptor
Protein Classification
Membrane receptor
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Family A G protein-coupled receptor
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Peptide receptor (family A GPCR)
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Short peptide receptor (family A GPCR)
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Vasopressin and oxytocin receptor
Uniprot ID
P37288
Gene Name
AVPR1A
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO Cricetulus griseus (Chinese hamster)  3
1
EC50 = 465 nM
   TI
   LI
   LO
   TS
2
IC50 = 778 nM
   TI
   LI
   LO
   TS
3
Ki = 344 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 Ki = 465 nM