BDBM26362 3-carboxamide indole compound, 23::7-{[(1Z)-2-cyano-2-(dimethylcarbamoyl)-1-{[(3S)-2-oxo-1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]azepan-3-yl]amino}eth-1-en-1-yl]amino}-1H-indole-3-carboxamide

SMILES: CN(C)C(=O)C(C#N)C(N[C@H]1CCCCN(CC(=O)N2CCCC2)C1=O)=Nc1cccc2c(c[nH]c12)C(N)=O

InChI Key: InChIKey=JIBXDTGKPQECST-ZYZRXSCRSA-N

Data: 1 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 1 hit for monomerid = 26362   

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
Coagulation factor X (Homo sapiens (Human))	BDBM26362 (3-carboxamide indole compound, 23 | 7-{[(1Z)-2-cya...) Show SMILES CN(C)C(=O)C(C#N)C(N[C@H]1CCCCN(CC(=O)N2CCCC2)C1=O)=Nc1cccc2c(c[nH]c12)C(N)=O |r,w:26.28| Show InChI InChI=1S/C27H34N8O4/c1-33(2)26(38)18(14-28)25(31-20-10-7-8-17-19(24(29)37)15-30-23(17)20)32-21-9-3-4-13-35(27(21)39)16-22(36)34-11-5-6-12-34/h7-8,10,15,18,21,30H,3-6,9,11-13,16H2,1-2H3,(H2,29,37)(H,31,32)/t18?,21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.70E+4	n/a	n/a	n/a	n/a	7.4	22
Bristol-Myers Squibb Company					Assay Description Time-dependent optical density change was followed at 405 nm using a kinetic microplate reader at room temperature. Enzyme activity in the presence o...				J Med Chem 51: 7541-51 (2008) Article DOI: 10.1021/jm800855x BindingDB Entry DOI: 10.7270/Q2V12332
					More data for this Ligand-Target Pair