Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Coagulation factor X' and Ligand = 'BDBM50112531'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Coagulation factor X (Homo sapiens (Human))	BDBM50112531 (4-(3-{2-Ethyl-6-[1-(1-imino-ethyl)-piperidin-4-ylo...) Show SMILES CCc1nc2ccc(OC3CCN(CC3)C(C)=N)cc2n1C\C=C\c1ccc(N)cc1 Show InChI InChI=1S/C25H31N5O/c1-3-25-28-23-11-10-22(31-21-12-15-29(16-13-21)18(2)26)17-24(23)30(25)14-4-5-19-6-8-20(27)9-7-19/h4-11,17,21,26H,3,12-16,27H2,1-2H3/b5-4+,26-18?	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	64	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Berlex Biosciences Curated by ChEMBL					Assay Description Tested in vitro for the inhibitory potency against Coagulation factor Xa				Bioorg Med Chem Lett 12: 1311-4 (2002) BindingDB Entry DOI: 10.7270/Q2X066CP
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