Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Coagulation factor X' and Ligand = 'BDBM50112507'   

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))	BDBM50112507 (5-[3-(3-Carbamimidoyl-phenyl)-allylamino]-2-[1-(1-...) Show SMILES CCOC(=O)c1cc(NC\C=C\c2cccc(c2)C(N)=N)ccc1OC1CCN(CC1)C(C)=N Show InChI InChI=1S/C26H33N5O3/c1-3-33-26(32)23-17-21(30-13-5-7-19-6-4-8-20(16-19)25(28)29)9-10-24(23)34-22-11-14-31(15-12-22)18(2)27/h4-10,16-17,22,27,30H,3,11-15H2,1-2H3,(H3,28,29)/b7-5+,27-18?	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	6.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Berlex Biosciences Curated by ChEMBL					Assay Description Competitive inhibition of coagulation factor Xa				Bioorg Med Chem Lett 12: 1307-10 (2002) BindingDB Entry DOI: 10.7270/Q21R6PV8
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