BDBM50205839 CHEMBL3925975

SMILES: CN1Cc2cc(NC(=O)CCc3cc(ccc3C3CC3)[C@@H](Nc3ccc4c(N)ncc(F)c4c3)C1=O)ccc2S(=O)(=O)C1CC1

InChI Key: InChIKey=YVGALPFQUVTTQF-JGCGQSQUSA-N

Data: 1 KI

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 = 50205839   

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 III/Factor VIIa (fVIIa) (Homo sapiens (Human))	BDBM50205839 (CHEMBL3925975) Show SMILES CN1Cc2cc(NC(=O)CCc3cc(ccc3C3CC3)[C@@H](Nc3ccc4c(N)ncc(F)c4c3)C1=O)ccc2S(=O)(=O)C1CC1 |r| Show InChI InChI=1S/C34H34FN5O4S/c1-40-18-22-15-23(7-12-30(22)45(43,44)25-8-9-25)38-31(41)13-5-20-14-21(4-10-26(20)19-2-3-19)32(34(40)42)39-24-6-11-27-28(16-24)29(35)17-37-33(27)36/h4,6-7,10-12,14-17,19,25,32,39H,2-3,5,8-9,13,18H2,1H3,(H2,36,37)(H,38,41)/t32-/m1/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	77	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Curated by ChEMBL					Assay Description Inhibition of recombinant human factor-7a/TF using S2288 as substrate measured after 60 mins at 37 degC				ACS Med Chem Lett 8: 67-72 (2017) Article DOI: 10.1021/acsmedchemlett.6b00375 BindingDB Entry DOI: 10.7270/Q20P120Q
					More data for this Ligand-Target Pair