Compile Data Set for Download or QSAR

Found 118 hits with Last Name = 'mary' and Initial = 'jl'   

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 (Oryctolagus cuniculus)	BDBM50324743 ((3R,4R)-1-(2,2-DIFLUORO-ETHYL)-PYRROLIDINE-3,4-DIC...) Show SMILES FC(F)CN1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)-n1ccccc1=O)C(=O)Nc1ccc(Cl)cn1 |r| Show InChI InChI=1S/C24H21ClF3N5O3/c25-14-4-7-21(29-10-14)31-24(36)17-12-32(13-20(27)28)11-16(17)23(35)30-19-6-5-15(9-18(19)26)33-8-2-1-3-22(33)34/h1-10,16-17,20H,11-13H2,(H,30,35)(H,29,31,36)/t16-,17-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	3.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to rabbit factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324771 ((3R,4R)-N3-(5-chloropyridin-2-yl)-N4-(2-fluoro-4-(...) Show SMILES Fc1cc(ccc1NC(=O)[C@H]1CN(CC(F)(F)F)C[C@@H]1C(=O)Nc1ccc(Cl)cn1)-n1ccccc1=O |r| Show InChI InChI=1S/C24H20ClF4N5O3/c25-14-4-7-20(30-10-14)32-23(37)17-12-33(13-24(27,28)29)11-16(17)22(36)31-19-6-5-15(9-18(19)26)34-8-2-1-3-21(34)35/h1-10,16-17H,11-13H2,(H,31,36)(H,30,32,37)/t16-,17-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324757 ((3R,4R)-N3-(4-chlorophenyl)-1-(N,N-dimethylsulfamo...) Show SMILES CN(C)S(=O)(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)-n1ccccc1=O)C(=O)Nc1ccc(Cl)cc1 |r| Show InChI InChI=1S/C25H25ClFN5O5S/c1-30(2)38(36,37)31-14-19(24(34)28-17-8-6-16(26)7-9-17)20(15-31)25(35)29-22-11-10-18(13-21(22)27)32-12-4-3-5-23(32)33/h3-13,19-20H,14-15H2,1-2H3,(H,28,34)(H,29,35)/t19-,20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324755 ((3R,4R)-N-(4-CHLOROPHENYL)-N'-[2-FLUORO-4-(2-OXOPY...) Show SMILES Fc1cc(ccc1NC(=O)[C@H]1CN(CC(F)(F)F)C[C@@H]1C(=O)Nc1ccc(Cl)cc1)-n1ccccc1=O |r| Show InChI InChI=1S/C25H21ClF4N4O3/c26-15-4-6-16(7-5-15)31-23(36)18-12-33(14-25(28,29)30)13-19(18)24(37)32-21-9-8-17(11-20(21)27)34-10-2-1-3-22(34)35/h1-11,18-19H,12-14H2,(H,31,36)(H,32,37)/t18-,19-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Similars	MMDB PDB Article PubMed	9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair				3D Structure (crystal)
Coagulation factor X (Homo sapiens (Human))	BDBM50324752 ((3R,4R)-N3-(4-chlorophenyl)-1-(2,2-difluoroethyl)-...) Show SMILES FC(F)CN1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)-n1ccccc1=O)C(=O)Nc1ccc(Cl)cc1 |r| Show InChI InChI=1S/C25H22ClF3N4O3/c26-15-4-6-16(7-5-15)30-24(35)18-12-32(14-22(28)29)13-19(18)25(36)31-21-9-8-17(11-20(21)27)33-10-2-1-3-23(33)34/h1-11,18-19,22H,12-14H2,(H,30,35)(H,31,36)/t18-,19-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324758 ((3R,4R)-N3-(4-chlorophenyl)-N4-(2-fluoro-4-(2-oxop...) Show SMILES CC(C)S(=O)(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)-n1ccccc1=O)C(=O)Nc1ccc(Cl)cc1 |r| Show InChI InChI=1S/C26H26ClFN4O5S/c1-16(2)38(36,37)31-14-20(25(34)29-18-8-6-17(27)7-9-18)21(15-31)26(35)30-23-11-10-19(13-22(23)28)32-12-4-3-5-24(32)33/h3-13,16,20-21H,14-15H2,1-2H3,(H,29,34)(H,30,35)/t20-,21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324754 ((3R,4R)-1-SULFAMOYL-PYRROLIDINE-3,4-DICARBOXYLIC A...) Show SMILES NS(=O)(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)-n1ccccc1=O)C(=O)Nc1ccc(Cl)cc1 |r| Show InChI InChI=1S/C23H21ClFN5O5S/c24-14-4-6-15(7-5-14)27-22(32)17-12-29(36(26,34)35)13-18(17)23(33)28-20-9-8-16(11-19(20)25)30-10-2-1-3-21(30)31/h1-11,17-18H,12-13H2,(H,27,32)(H,28,33)(H2,26,34,35)/t17-,18-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Similars	MMDB PDB Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair				3D Structure (crystal)
Coagulation factor X (Homo sapiens (Human))	BDBM50324749 ((3R,4R)-N3-(4-chlorophenyl)-1-(ethylsulfonyl)-N4-(...) Show SMILES CCS(=O)(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)-n1ccccc1=O)C(=O)Nc1ccc(Cl)cc1 |r| Show InChI InChI=1S/C25H24ClFN4O5S/c1-2-37(35,36)30-14-19(24(33)28-17-8-6-16(26)7-9-17)20(15-30)25(34)29-22-11-10-18(13-21(22)27)31-12-4-3-5-23(31)32/h3-13,19-20H,2,14-15H2,1H3,(H,28,33)(H,29,34)/t19-,20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324767 ((3R,4R)-N3-(4-chlorophenyl)-N4-(2-fluoro-4-(2-oxop...) Show SMILES Fc1cc(ccc1NC(=O)[C@H]1CN(Cc2cccs2)C[C@@H]1C(=O)Nc1ccc(Cl)cc1)-n1ccccc1=O |r| Show InChI InChI=1S/C28H24ClFN4O3S/c29-18-6-8-19(9-7-18)31-27(36)22-16-33(15-21-4-3-13-38-21)17-23(22)28(37)32-25-11-10-20(14-24(25)30)34-12-2-1-5-26(34)35/h1-14,22-23H,15-17H2,(H,31,36)(H,32,37)/t22-,23-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324787 ((3R,4R)-N3-(4-chlorophenyl)-1-(methylsulfonyl)-N4-...) Show SMILES CS(=O)(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1)-n1ccccc1=O)C(=O)Nc1ccc(Cl)cc1 |r| Show InChI InChI=1S/C24H23ClN4O5S/c1-35(33,34)28-14-20(23(31)26-17-7-5-16(25)6-8-17)21(15-28)24(32)27-18-9-11-19(12-10-18)29-13-3-2-4-22(29)30/h2-13,20-21H,14-15H2,1H3,(H,26,31)(H,27,32)/t20-,21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	14	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324744 ((3R,4R)-N3-(5-chloropyridin-2-yl)-N4-(2-fluoro-4-(...) Show SMILES CC(C)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)-n1ccccc1=O)C(=O)Nc1ccc(Cl)cn1 |r| Show InChI InChI=1S/C25H25ClFN5O3/c1-15(2)31-13-18(19(14-31)25(35)30-22-9-6-16(26)12-28-22)24(34)29-21-8-7-17(11-20(21)27)32-10-4-3-5-23(32)33/h3-12,15,18-19H,13-14H2,1-2H3,(H,29,34)(H,28,30,35)/t18-,19-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324746 ((3R,4R)-1-METHANESULFONYL-PYRROLIDINE-3,4-DICARBOX...) Show SMILES CS(=O)(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)-n1ccccc1=O)C(=O)Nc1ccc(Cl)cc1 |r| Show InChI InChI=1S/C24H22ClFN4O5S/c1-36(34,35)29-13-18(23(32)27-16-7-5-15(25)6-8-16)19(14-29)24(33)28-21-10-9-17(12-20(21)26)30-11-3-2-4-22(30)31/h2-12,18-19H,13-14H2,1H3,(H,27,32)(H,28,33)/t18-,19-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Similars	MMDB PDB Article PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair				3D Structure (crystal)
Coagulation factor X (Homo sapiens (Human))	BDBM50324789 ((3R,4R)-N3-(4-chlorophenyl)-N4-(2-fluoro-4-(3-meth...) Show SMILES Cc1cccn(-c2ccc(NC(=O)[C@H]3CN(C[C@@H]3C(=O)Nc3ccc(Cl)cc3)S(C)(=O)=O)c(F)c2)c1=O |r| Show InChI InChI=1S/C25H24ClFN4O5S/c1-15-4-3-11-31(25(15)34)18-9-10-22(21(27)12-18)29-24(33)20-14-30(37(2,35)36)13-19(20)23(32)28-17-7-5-16(26)6-8-17/h3-12,19-20H,13-14H2,1-2H3,(H,28,32)(H,29,33)/t19-,20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Oryctolagus cuniculus)	BDBM50324745 ((3R,4R)-methyl 3-(5-chloropyridin-2-ylcarbamoyl)-4...) Show SMILES COC(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)-n1ccccc1=O)C(=O)Nc1ccc(Cl)cn1 |r| Show InChI InChI=1S/C24H21ClFN5O5/c1-36-24(35)30-12-16(17(13-30)23(34)29-20-8-5-14(25)11-27-20)22(33)28-19-7-6-15(10-18(19)26)31-9-3-2-4-21(31)32/h2-11,16-17H,12-13H2,1H3,(H,28,33)(H,27,29,34)/t16-,17-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	17	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to rabbit factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324753 ((3R,4R)-N3-(4-chlorophenyl)-N4-(2-fluoro-4-(2-oxop...) Show SMILES CC(C)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)-n1ccccc1=O)C(=O)Nc1ccc(Cl)cc1 |r| Show InChI InChI=1S/C26H26ClFN4O3/c1-16(2)31-14-20(25(34)29-18-8-6-17(27)7-9-18)21(15-31)26(35)30-23-11-10-19(13-22(23)28)32-12-4-3-5-24(32)33/h3-13,16,20-21H,14-15H2,1-2H3,(H,29,34)(H,30,35)/t20-,21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	17	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324756 ((3R,4R)-N3-(4-chlorophenyl)-N4-(2-fluoro-4-(2-oxop...) Show SMILES Fc1cc(ccc1NC(=O)[C@H]1CN(C[C@@H]1C(=O)Nc1ccc(Cl)cc1)S(=O)(=O)CC(F)(F)F)-n1ccccc1=O |r| Show InChI InChI=1S/C25H21ClF4N4O5S/c26-15-4-6-16(7-5-15)31-23(36)18-12-33(40(38,39)14-25(28,29)30)13-19(18)24(37)32-21-9-8-17(11-20(21)27)34-10-2-1-3-22(34)35/h1-11,18-19H,12-14H2,(H,31,36)(H,32,37)/t18-,19-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	17	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324762 ((3R,4R)-N3-(4-chlorophenyl)-N4-(2-fluoro-4-(2-oxop...) Show SMILES CCCS(=O)(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)-n1ccccc1=O)C(=O)Nc1ccc(Cl)cc1 |r| Show InChI InChI=1S/C26H26ClFN4O5S/c1-2-13-38(36,37)31-15-20(25(34)29-18-8-6-17(27)7-9-18)21(16-31)26(35)30-23-11-10-19(14-22(23)28)32-12-4-3-5-24(32)33/h3-12,14,20-21H,2,13,15-16H2,1H3,(H,29,34)(H,30,35)/t20-,21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	18	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324769 ((3R,4R)-N3-(5-chloropyridin-2-yl)-N4-(2-fluoro-4-(...) Show SMILES CS(=O)(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)-n1ccccc1=O)C(=O)Nc1ccc(Cl)cn1 |r| Show InChI InChI=1S/C23H21ClFN5O5S/c1-36(34,35)29-12-16(17(13-29)23(33)28-20-8-5-14(24)11-26-20)22(32)27-19-7-6-15(10-18(19)25)30-9-3-2-4-21(30)31/h2-11,16-17H,12-13H2,1H3,(H,27,32)(H,26,28,33)/t16-,17-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324764 ((3R,4R)-N3-(4-chlorophenyl)-N4-(2-fluoro-4-(2-oxop...) Show SMILES FCCN1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)-n1ccccc1=O)C(=O)Nc1ccc(Cl)cc1 |r| Show InChI InChI=1S/C25H23ClF2N4O3/c26-16-4-6-17(7-5-16)29-24(34)19-14-31(12-10-27)15-20(19)25(35)30-22-9-8-18(13-21(22)28)32-11-2-1-3-23(32)33/h1-9,11,13,19-20H,10,12,14-15H2,(H,29,34)(H,30,35)/t19-,20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	21	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324792 ((3R,4R)-N3-(4-chlorophenyl)-N4-(2-methyl-4-(2-oxop...) Show SMILES Cc1cc(ccc1NC(=O)[C@H]1CN(C[C@@H]1C(=O)Nc1ccc(Cl)cc1)S(C)(=O)=O)-n1ccccc1=O |r| Show InChI InChI=1S/C25H25ClN4O5S/c1-16-13-19(30-12-4-3-5-23(30)31)10-11-22(16)28-25(33)21-15-29(36(2,34)35)14-20(21)24(32)27-18-8-6-17(26)7-9-18/h3-13,20-21H,14-15H2,1-2H3,(H,27,32)(H,28,33)/t20-,21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	22	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324751 ((3R,4R)-methyl 3-(4-chlorophenylcarbamoyl)-4-(2-fl...) Show SMILES COC(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)-n1ccccc1=O)C(=O)Nc1ccc(Cl)cc1 |r| Show InChI InChI=1S/C25H22ClFN4O5/c1-36-25(35)30-13-18(23(33)28-16-7-5-15(26)6-8-16)19(14-30)24(34)29-21-10-9-17(12-20(21)27)31-11-3-2-4-22(31)32/h2-12,18-19H,13-14H2,1H3,(H,28,33)(H,29,34)/t18-,19-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	22	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324795 ((3R,4R)-N3-(4-chlorophenyl)-1-(methylsulfonyl)-N4-...) Show SMILES CS(=O)(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1)N1CCOCC1=O)C(=O)Nc1ccc(Cl)cc1 |r| Show InChI InChI=1S/C23H25ClN4O6S/c1-35(32,33)27-12-19(22(30)25-16-4-2-15(24)3-5-16)20(13-27)23(31)26-17-6-8-18(9-7-17)28-10-11-34-14-21(28)29/h2-9,19-20H,10-14H2,1H3,(H,25,30)(H,26,31)/t19-,20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	24	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324750 ((3R,4R)-N3-(4-chlorophenyl)-N4-(2-fluoro-4-(2-oxop...) Show SMILES OCCN1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)-n1ccccc1=O)C(=O)Nc1ccc(Cl)cc1 |r| Show InChI InChI=1S/C25H24ClFN4O4/c26-16-4-6-17(7-5-16)28-24(34)19-14-30(11-12-32)15-20(19)25(35)29-22-9-8-18(13-21(22)27)31-10-2-1-3-23(31)33/h1-10,13,19-20,32H,11-12,14-15H2,(H,28,34)(H,29,35)/t19-,20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	24	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324742 ((3R,4R)-N3-(5-chloropyridin-2-yl)-1-(ethylsulfonyl...) Show SMILES CCS(=O)(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)-n1ccccc1=O)C(=O)Nc1ccc(Cl)cn1 |r| Show InChI InChI=1S/C24H23ClFN5O5S/c1-2-37(35,36)30-13-17(18(14-30)24(34)29-21-9-6-15(25)12-27-21)23(33)28-20-8-7-16(11-19(20)26)31-10-4-3-5-22(31)32/h3-12,17-18H,2,13-14H2,1H3,(H,28,33)(H,27,29,34)/t17-,18-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	24	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324745 ((3R,4R)-methyl 3-(5-chloropyridin-2-ylcarbamoyl)-4...) Show SMILES COC(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)-n1ccccc1=O)C(=O)Nc1ccc(Cl)cn1 |r| Show InChI InChI=1S/C24H21ClFN5O5/c1-36-24(35)30-12-16(17(13-30)23(34)29-20-8-5-14(25)11-27-20)22(33)28-19-7-6-15(10-18(19)26)31-9-3-2-4-21(31)32/h2-11,16-17H,12-13H2,1H3,(H,28,33)(H,27,29,34)/t16-,17-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	27	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324745 ((3R,4R)-methyl 3-(5-chloropyridin-2-ylcarbamoyl)-4...) Show SMILES COC(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)-n1ccccc1=O)C(=O)Nc1ccc(Cl)cn1 |r| Show InChI InChI=1S/C24H21ClFN5O5/c1-36-24(35)30-12-16(17(13-30)23(34)29-20-8-5-14(25)11-27-20)22(33)28-19-7-6-15(10-18(19)26)31-9-3-2-4-21(31)32/h2-11,16-17H,12-13H2,1H3,(H,28,33)(H,27,29,34)/t16-,17-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	27	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324748 ((3R,4R)-1-acetyl-N3-(4-chlorophenyl)-N4-(2-fluoro-...) Show SMILES CC(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)-n1ccccc1=O)C(=O)Nc1ccc(Cl)cc1 |r| Show InChI InChI=1S/C25H22ClFN4O4/c1-15(32)30-13-19(24(34)28-17-7-5-16(26)6-8-17)20(14-30)25(35)29-22-10-9-18(12-21(22)27)31-11-3-2-4-23(31)33/h2-12,19-20H,13-14H2,1H3,(H,28,34)(H,29,35)/t19-,20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	28	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324784 ((3R,4R)-N3-(4-chlorophenyl)-N4-(2,6-difluoro-4-(2-...) Show SMILES CS(=O)(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1c(F)cc(cc1F)-n1ccccc1=O)C(=O)Nc1ccc(Cl)cc1 |r| Show InChI InChI=1S/C24H21ClF2N4O5S/c1-37(35,36)30-12-17(23(33)28-15-7-5-14(25)6-8-15)18(13-30)24(34)29-22-19(26)10-16(11-20(22)27)31-9-3-2-4-21(31)32/h2-11,17-18H,12-13H2,1H3,(H,28,33)(H,29,34)/t17-,18-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	31	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324765 ((3R,4R)-N3-(4-chlorophenyl)-N4-(2-fluoro-4-(2-oxop...) Show SMILES Fc1cc(ccc1NC(=O)[C@H]1CN(Cc2ccncc2)C[C@@H]1C(=O)Nc1ccc(Cl)cc1)-n1ccccc1=O |r| Show InChI InChI=1S/C29H25ClFN5O3/c30-20-4-6-21(7-5-20)33-28(38)23-17-35(16-19-10-12-32-13-11-19)18-24(23)29(39)34-26-9-8-22(15-25(26)31)36-14-2-1-3-27(36)37/h1-15,23-24H,16-18H2,(H,33,38)(H,34,39)/t23-,24-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	34	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324782 ((3R,4R)-N3-(5-chlorothiophen-2-yl)-1-(2,2-difluoro...) Show SMILES FC(F)CN1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)-n1ccccc1=O)C(=O)Nc1ccc(Cl)s1 |r| Show InChI InChI=1S/C23H20ClF3N4O3S/c24-18-6-7-20(35-18)29-23(34)15-11-30(12-19(26)27)10-14(15)22(33)28-17-5-4-13(9-16(17)25)31-8-2-1-3-21(31)32/h1-9,14-15,19H,10-12H2,(H,28,33)(H,29,34)/t14-,15-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	36	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324794 ((3R,4R)-N3-(4-chlorophenyl)-1-(methylsulfonyl)-N4-...) Show SMILES CS(=O)(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cn1)-n1ccccc1=O)C(=O)Nc1ccc(Cl)cc1 |r| Show InChI InChI=1S/C23H22ClN5O5S/c1-35(33,34)28-13-18(22(31)26-16-7-5-15(24)6-8-16)19(14-28)23(32)27-20-10-9-17(12-25-20)29-11-3-2-4-21(29)30/h2-12,18-19H,13-14H2,1H3,(H,26,31)(H,25,27,32)/t18-,19-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324790 ((3R,4R)-N3-(4-chlorophenyl)-N4-(3-fluoro-2'-(methy...) Show SMILES CS(=O)(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)-c1ccccc1S(C)(=O)=O)C(=O)Nc1ccc(Cl)cc1 |r| Show InChI InChI=1S/C26H25ClFN3O6S2/c1-38(34,35)24-6-4-3-5-19(24)16-7-12-23(22(28)13-16)30-26(33)21-15-31(39(2,36)37)14-20(21)25(32)29-18-10-8-17(27)9-11-18/h3-13,20-21H,14-15H2,1-2H3,(H,29,32)(H,30,33)/t20-,21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324788 ((3R,4R)-N3-(4-chlorophenyl)-1-(methylsulfonyl)-N4-...) Show SMILES CS(=O)(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cn1)-c1ccccc1S(C)(=O)=O)C(=O)Nc1ccc(Cl)cc1 |r| Show InChI InChI=1S/C25H25ClN4O6S2/c1-37(33,34)22-6-4-3-5-19(22)16-7-12-23(27-13-16)29-25(32)21-15-30(38(2,35)36)14-20(21)24(31)28-18-10-8-17(26)9-11-18/h3-13,20-21H,14-15H2,1-2H3,(H,28,31)(H,27,29,32)/t20-,21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	42	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324768 ((3R,4R)-N3-(4-chlorophenyl)-1-(cyanomethyl)-N4-(2-...) Show SMILES Fc1cc(ccc1NC(=O)[C@H]1CN(CC#N)C[C@@H]1C(=O)Nc1ccc(Cl)cc1)-n1ccccc1=O |r| Show InChI InChI=1S/C25H21ClFN5O3/c26-16-4-6-17(7-5-16)29-24(34)19-14-31(12-10-28)15-20(19)25(35)30-22-9-8-18(13-21(22)27)32-11-2-1-3-23(32)33/h1-9,11,13,19-20H,12,14-15H2,(H,29,34)(H,30,35)/t19-,20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	42	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324766 ((3R,4R)-N3-(4-chlorophenyl)-N4-(2-fluoro-4-(2-oxop...) Show SMILES COCCN1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)-n1ccccc1=O)C(=O)Nc1ccc(Cl)cc1 |r| Show InChI InChI=1S/C26H26ClFN4O4/c1-36-13-12-31-15-20(25(34)29-18-7-5-17(27)6-8-18)21(16-31)26(35)30-23-10-9-19(14-22(23)28)32-11-3-2-4-24(32)33/h2-11,14,20-21H,12-13,15-16H2,1H3,(H,29,34)(H,30,35)/t20-,21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	44	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324763 ((3R,4R)-N3-(4-chlorophenyl)-1-(cyclopropylmethyl)-...) Show SMILES Fc1cc(ccc1NC(=O)[C@H]1CN(CC2CC2)C[C@@H]1C(=O)Nc1ccc(Cl)cc1)-n1ccccc1=O |r| Show InChI InChI=1S/C27H26ClFN4O3/c28-18-6-8-19(9-7-18)30-26(35)21-15-32(14-17-4-5-17)16-22(21)27(36)31-24-11-10-20(13-23(24)29)33-12-2-1-3-25(33)34/h1-3,6-13,17,21-22H,4-5,14-16H2,(H,30,35)(H,31,36)/t21-,22-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	46	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324793 ((3R,4R)-N3-(4-chlorophenyl)-N4-(2-fluoro-4-(3-oxom...) Show SMILES CS(=O)(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)N1CCOCC1=O)C(=O)Nc1ccc(Cl)cc1 |r| Show InChI InChI=1S/C23H24ClFN4O6S/c1-36(33,34)28-11-17(22(31)26-15-4-2-14(24)3-5-15)18(12-28)23(32)27-20-7-6-16(10-19(20)25)29-8-9-35-13-21(29)30/h2-7,10,17-18H,8-9,11-13H2,1H3,(H,26,31)(H,27,32)/t17-,18-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	46	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324761 ((3R,4R)-propyl 3-(4-chlorophenylcarbamoyl)-4-(2-fl...) Show SMILES CCCOC(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)-n1ccccc1=O)C(=O)Nc1ccc(Cl)cc1 |r| Show InChI InChI=1S/C27H26ClFN4O5/c1-2-13-38-27(37)32-15-20(25(35)30-18-8-6-17(28)7-9-18)21(16-32)26(36)31-23-11-10-19(14-22(23)29)33-12-4-3-5-24(33)34/h3-12,14,20-21H,2,13,15-16H2,1H3,(H,30,35)(H,31,36)/t20-,21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	47	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324759 ((3R,4R)-ethyl 3-(4-chlorophenylcarbamoyl)-4-(2-flu...) Show SMILES CCOC(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)-n1ccccc1=O)C(=O)Nc1ccc(Cl)cc1 |r| Show InChI InChI=1S/C26H24ClFN4O5/c1-2-37-26(36)31-14-19(24(34)29-17-8-6-16(27)7-9-17)20(15-31)25(35)30-22-11-10-18(13-21(22)28)32-12-4-3-5-23(32)33/h3-13,19-20H,2,14-15H2,1H3,(H,29,34)(H,30,35)/t19-,20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	54	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324770 ((3R,4R)-N3-(5-chloropyridin-2-yl)-N4-(2-fluoro-4-(...) Show SMILES Fc1cc(ccc1NC(=O)[C@H]1CNC[C@@H]1C(=O)Nc1ccc(Cl)cn1)-n1ccccc1=O |r| Show InChI InChI=1S/C22H19ClFN5O3/c23-13-4-7-19(26-10-13)28-22(32)16-12-25-11-15(16)21(31)27-18-6-5-14(9-17(18)24)29-8-2-1-3-20(29)30/h1-10,15-16,25H,11-12H2,(H,27,31)(H,26,28,32)/t15-,16-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	55	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324779 ((3R,4R)-1-METHANESULFONYL-PYRROLIDINE-3,4-DICARBOX...) Show SMILES CS(=O)(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)-n1ccccc1=O)C(=O)Nc1ccc(Cl)c(F)c1 |r| Show InChI InChI=1S/C24H21ClF2N4O5S/c1-37(35,36)30-12-16(23(33)28-14-5-7-18(25)19(26)10-14)17(13-30)24(34)29-21-8-6-15(11-20(21)27)31-9-3-2-4-22(31)32/h2-11,16-17H,12-13H2,1H3,(H,28,33)(H,29,34)/t16-,17-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Similars	MMDB PDB Article PubMed	62	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair				3D Structure (crystal)
Coagulation factor X (Homo sapiens (Human))	BDBM50324760 ((3R,4R)-N3-(4-chlorophenyl)-N4-(2-fluoro-4-(2-oxop...) Show SMILES Fc1cc(ccc1NC(=O)[C@H]1CN(C[C@@H]1C(=O)Nc1ccc(Cl)cc1)C(=O)N1CCCC1)-n1ccccc1=O |r| Show InChI InChI=1S/C28H27ClFN5O4/c29-18-6-8-19(9-7-18)31-26(37)21-16-34(28(39)33-12-3-4-13-33)17-22(21)27(38)32-24-11-10-20(15-23(24)30)35-14-2-1-5-25(35)36/h1-2,5-11,14-15,21-22H,3-4,12-13,16-17H2,(H,31,37)(H,32,38)/t21-,22-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	71	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324783 ((3R,4R)-N3-(4-chlorophenyl)-N4-(4-(2,5-dihydro-1H-...) Show SMILES CS(=O)(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1)C(=O)N1CC=CC1)C(=O)Nc1ccc(Cl)cc1 |r,c:24| Show InChI InChI=1S/C24H25ClN4O5S/c1-35(33,34)29-14-20(21(15-29)23(31)27-19-10-6-17(25)7-11-19)22(30)26-18-8-4-16(5-9-18)24(32)28-12-2-3-13-28/h2-11,20-21H,12-15H2,1H3,(H,26,30)(H,27,31)/t20-,21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	92	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Rattus norvegicus (rat))	BDBM50324743 ((3R,4R)-1-(2,2-DIFLUORO-ETHYL)-PYRROLIDINE-3,4-DIC...) Show SMILES FC(F)CN1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)-n1ccccc1=O)C(=O)Nc1ccc(Cl)cn1 |r| Show InChI InChI=1S/C24H21ClF3N5O3/c25-14-4-7-21(29-10-14)31-24(36)17-12-32(13-20(27)28)11-16(17)23(35)30-19-6-5-15(9-18(19)26)33-8-2-1-3-22(33)34/h1-10,16-17,20H,11-13H2,(H,30,35)(H,29,31,36)/t16-,17-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to rat factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324747 ((3R,4R)-N3-(4-chlorophenyl)-N4-(2-fluoro-4-(2-oxop...) Show SMILES Fc1cc(ccc1NC(=O)[C@H]1CNC[C@@H]1C(=O)Nc1ccc(Cl)cc1)-n1ccccc1=O |r| Show InChI InChI=1S/C23H20ClFN4O3/c24-14-4-6-15(7-5-14)27-22(31)17-12-26-13-18(17)23(32)28-20-9-8-16(11-19(20)25)29-10-2-1-3-21(29)30/h1-11,17-18,26H,12-13H2,(H,27,31)(H,28,32)/t17-,18-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	120	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324786 ((3R,4R)-N3-(4-chlorophenyl)-N4-(2-fluoro-4-(2-oxop...) Show SMILES CS(=O)(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)N1CCCCC1=O)C(=O)Nc1ccc(Cl)cc1 |r| Show InChI InChI=1S/C24H26ClFN4O5S/c1-36(34,35)29-13-18(23(32)27-16-7-5-15(25)6-8-16)19(14-29)24(33)28-21-10-9-17(12-20(21)26)30-11-3-2-4-22(30)31/h5-10,12,18-19H,2-4,11,13-14H2,1H3,(H,27,32)(H,28,33)/t18-,19-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	124	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324777 ((3R,4R)-N3-(4-chloro-2-fluorophenyl)-N4-(2-fluoro-...) Show SMILES CS(=O)(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)-n1ccccc1=O)C(=O)Nc1ccc(Cl)cc1F |r| Show InChI InChI=1S/C24H21ClF2N4O5S/c1-37(35,36)30-12-16(23(33)28-20-7-5-14(25)10-18(20)26)17(13-30)24(34)29-21-8-6-15(11-19(21)27)31-9-3-2-4-22(31)32/h2-11,16-17H,12-13H2,1H3,(H,28,33)(H,29,34)/t16-,17-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	130	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324775 ((3R,4R)-1-METHANESULFONYL-PYRROLIDINE-3,4--DICARBO...) Show SMILES COc1ccc(NC(=O)[C@H]2CN(C[C@@H]2C(=O)Nc2ccc(cc2F)-n2ccccc2=O)S(C)(=O)=O)cc1F |r| Show InChI InChI=1S/C25H24F2N4O6S/c1-37-22-9-6-15(11-20(22)27)28-24(33)17-13-30(38(2,35)36)14-18(17)25(34)29-21-8-7-16(12-19(21)26)31-10-4-3-5-23(31)32/h3-12,17-18H,13-14H2,1-2H3,(H,28,33)(H,29,34)/t17-,18-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Similars	MMDB PDB Article PubMed	192	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair				3D Structure (crystal)
Coagulation factor X (Homo sapiens (Human))	BDBM50324791 (CHEMBL1221488) Show SMILES CS(=O)(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1)N1CCCCS1(=O)=O)C(=O)Nc1ccc(Cl)cc1 |r| Show InChI InChI=1S/C23H27ClN4O6S2/c1-35(31,32)27-14-20(22(29)25-17-6-4-16(24)5-7-17)21(15-27)23(30)26-18-8-10-19(11-9-18)28-12-2-3-13-36(28,33)34/h4-11,20-21H,2-3,12-15H2,1H3,(H,25,29)(H,26,30)/t20-,21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	201	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50324772 ((3R,4R)-N3-(2-fluoro-4-(2-oxopyridin-1(2H)-yl)phen...) Show SMILES CS(=O)(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1F)-n1ccccc1=O)C(=O)Nc1ccc2[nH]ccc2c1 |r| Show InChI InChI=1S/C26H24FN5O5S/c1-38(36,37)31-14-19(25(34)29-17-5-7-22-16(12-17)9-10-28-22)20(15-31)26(35)30-23-8-6-18(13-21(23)27)32-11-3-2-4-24(32)33/h2-13,19-20,28H,14-15H2,1H3,(H,29,34)(H,30,35)/t19-,20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	345	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to factor 10a				Bioorg Med Chem Lett 20: 5313-9 (2010) Article DOI: 10.1016/j.bmcl.2010.06.126 BindingDB Entry DOI: 10.7270/Q2542NSG
					More data for this Ligand-Target Pair

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