Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Coagulation factor VII' and Ligand = 'BDBM189442'   

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 VII (Homo sapiens (Human))	BDBM189442 (US9174974, Example 27) Show SMILES C[C@H]1COC(=O)Nc2cc(F)c(O[C@@H]3COC[C@@H]3O)c(CN(C)C(=O)[C@H](Nc3ccc4c(N)nccc4c3)c3ccc1c(C)c3)c2 |r| Show InChI InChI=1S/C34H36FN5O6/c1-18-10-21-4-6-25(18)19(2)15-45-34(43)39-24-12-22(31(27(35)13-24)46-29-17-44-16-28(29)41)14-40(3)33(42)30(21)38-23-5-7-26-20(11-23)8-9-37-32(26)36/h4-13,19,28-30,38,41H,14-17H2,1-3H3,(H2,36,37)(H,39,43)/t19-,28-,29+,30+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	0.230	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description FVIIa-Xase Ki (37° C.): S2765 (0.5 mM), PCPS (25 μM), calcium chloride (5 mM), full-length human TF (3 nM), human FVIIa (5 pM), and FVIIa inhibi...				US Patent US9174974 (2015) BindingDB Entry DOI: 10.7270/Q2W37V32
					More data for this Ligand-Target Pair
Coagulation factor VII (Homo sapiens (Human))	BDBM189442 (US9174974, Example 27) Show SMILES C[C@H]1COC(=O)Nc2cc(F)c(O[C@@H]3COC[C@@H]3O)c(CN(C)C(=O)[C@H](Nc3ccc4c(N)nccc4c3)c3ccc1c(C)c3)c2 |r| Show InChI InChI=1S/C34H36FN5O6/c1-18-10-21-4-6-25(18)19(2)15-45-34(43)39-24-12-22(31(27(35)13-24)46-29-17-44-16-28(29)41)14-40(3)33(42)30(21)38-23-5-7-26-20(11-23)8-9-37-32(26)36/h4-13,19,28-30,38,41H,14-17H2,1-3H3,(H2,36,37)(H,39,43)/t19-,28-,29+,30+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	320	n/a	n/a	n/a	n/a	n/a	n/a	7.4	n/a
Bristol-Myers Squibb Company US Patent					Assay Description Tissue kallikrein-1 (37° C) activity was determined in reactions containing 0.05 nM enzyme and 90 μM substrate (H-D-Val-Leu-Arg-AFC) in buffer (...				US Patent US9174974 (2015) BindingDB Entry DOI: 10.7270/Q2W37V32
					More data for this Ligand-Target Pair