BDBM50065114 CHEMBL314344::N-[4-(5H,11H-Benzo[e]pyrrolo[1,2-a][1,4]diazepine-10-carbonyl)-3-chloro-phenyl]-2-fluoro-3-trifluoromethyl-benzamide

SMILES: Fc1c(cccc1C(F)(F)F)C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc23)c(Cl)c1

InChI Key: InChIKey=BSSDOMCYBIQOPS-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50065114   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Vasopressin V2 receptor (Homo sapiens (Human))	BDBM50065114 (CHEMBL314344 | N-[4-(5H,11H-Benzo[e]pyrrolo[1,2-a]...) Show SMILES Fc1c(cccc1C(F)(F)F)C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc23)c(Cl)c1 Show InChI InChI=1S/C27H18ClF4N3O2/c28-22-13-17(33-25(36)20-7-3-8-21(24(20)29)27(30,31)32)10-11-19(22)26(37)35-15-18-6-4-12-34(18)14-16-5-1-2-9-23(16)35/h1-13H,14-15H2,(H,33,36)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.30	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth-Ayerst Research Curated by ChEMBL					Assay Description Displacement of [3H]-AVP from human V2 receptor expressed in murine fibroblast cell line (LV2) membranes				J Med Chem 41: 2442-4 (1998) Article DOI: 10.1021/jm980179c BindingDB Entry DOI: 10.7270/Q2CC0ZT5
					More data for this Ligand-Target Pair
Vasopressin V1a receptor (Homo sapiens (Human))	BDBM50065114 (CHEMBL314344 | N-[4-(5H,11H-Benzo[e]pyrrolo[1,2-a]...) Show SMILES Fc1c(cccc1C(F)(F)F)C(=O)Nc1ccc(C(=O)N2Cc3cccn3Cc3ccccc23)c(Cl)c1 Show InChI InChI=1S/C27H18ClF4N3O2/c28-22-13-17(33-25(36)20-7-3-8-21(24(20)29)27(30,31)32)10-11-19(22)26(37)35-15-18-6-4-12-34(18)14-16-5-1-2-9-23(16)35/h1-13H,14-15H2,(H,33,36)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth-Ayerst Research Curated by ChEMBL					Assay Description Displacement of [3H]-AVP from vasopressin receptor (V1a) from human platelet membranes.				J Med Chem 41: 2442-4 (1998) Article DOI: 10.1021/jm980179c BindingDB Entry DOI: 10.7270/Q2CC0ZT5
					More data for this Ligand-Target Pair