BDBM26356 indazol-7-yl compound, 17::methyl (2Z)-2-cyano-3-(1H-indazol-7-ylamino)-3-{[(3S)-2-oxo-1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]azepan-3-yl]amino}prop-2-enoate

SMILES: COC(=O)C(C#N)C(N[C@H]1CCCCN(CC(=O)N2CCCC2)C1=O)=Nc1cccc2c[nH]nc12

InChI Key: InChIKey=CIADMZOYTVAQSC-NNBQYGFHSA-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 = 26356   

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))	BDBM26356 (indazol-7-yl compound, 17 | methyl (2Z)-2-cyano-3-...) Show SMILES COC(=O)C(C#N)C(N[C@H]1CCCCN(CC(=O)N2CCCC2)C1=O)=Nc1cccc2c[nH]nc12 |r,w:25.27| Show InChI InChI=1S/C24H29N7O4/c1-35-24(34)17(13-25)22(27-18-9-6-7-16-14-26-29-21(16)18)28-19-8-2-3-12-31(23(19)33)15-20(32)30-10-4-5-11-30/h6-7,9,14,17,19H,2-5,8,10-12,15H2,1H3,(H,26,29)(H,27,28)/t17?,19-/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	1.37E+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
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