Compile Data Set for Download or QSAR

Found 157 hits with Last Name = 'gaudette' and Initial = 'j'   

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
Prothrombin (Homo sapiens (Human))	BDBM50067796 (CHEMBL11157 | L-374087 | N-((6-amino-2-methylpyrid...) Show SMILES Cc1nc(N)ccc1CNC(=O)Cn1c(C)ccc(NS(=O)(=O)Cc2ccccc2)c1=O Show InChI InChI=1S/C22H25N5O4S/c1-15-8-10-19(26-32(30,31)14-17-6-4-3-5-7-17)22(29)27(15)13-21(28)24-12-18-9-11-20(23)25-16(18)2/h3-11,26H,12-14H2,1-2H3,(H2,23,25)(H,24,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.700	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50067797 (CHEMBL19080 | L-37378 | N-(6-Amino-2-methyl-pyridi...) Show SMILES Cc1nc(N)ccc1CNC(=O)Cn1c(C)cnc(NCCc2ccccc2)c1=O Show InChI InChI=1S/C22H26N6O2/c1-15-12-26-21(24-11-10-17-6-4-3-5-7-17)22(30)28(15)14-20(29)25-13-18-8-9-19(23)27-16(18)2/h3-9,12H,10-11,13-14H2,1-2H3,(H2,23,27)(H,24,26)(H,25,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50215314 (CHEMBL100049) Show SMILES Cc1cnc(NCC(F)(F)c2ccccc2)c(=O)n1CC(=O)NCc1ccc2c(N)noc2c1 Show InChI InChI=1S/C23H22F2N6O3/c1-14-10-28-21(29-13-23(24,25)16-5-3-2-4-6-16)22(33)31(14)12-19(32)27-11-15-7-8-17-18(9-15)34-30-20(17)26/h2-10H,11-13H2,1H3,(H2,26,30)(H,27,32)(H,28,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	2.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50215447 (CHEMBL101867) Show SMILES Cc1cnc(NCCc2ccc3OCCc3c2)c(=O)n1CC(=O)NCc1ccc2[nH]ncc2c1 Show InChI InChI=1S/C25H26N6O3/c1-16-12-28-24(26-8-6-17-3-5-22-19(10-17)7-9-34-22)25(33)31(16)15-23(32)27-13-18-2-4-21-20(11-18)14-29-30-21/h2-5,10-12,14H,6-9,13,15H2,1H3,(H,26,28)(H,27,32)(H,29,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	2.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50221531 (6-methoxy-7-(3-(4-methylpiperazin-1-yl)propoxy)-4-...) Show SMILES COc1cc2c(N[C@@H]3C[C@H]3c3ccccc3)c(cnc2cc1OCCCN1CCN(C)CC1)C#N Show InChI InChI=1S/C28H33N5O2/c1-32-10-12-33(13-11-32)9-6-14-35-27-17-24-23(16-26(27)34-2)28(21(18-29)19-30-24)31-25-15-22(25)20-7-4-3-5-8-20/h3-5,7-8,16-17,19,22,25H,6,9-15H2,1-2H3,(H,30,31)/t22-,25+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tanabe Research Laboratories USA, Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant EGFR by fluorescence polarization assay				Bioorg Med Chem Lett 17: 5978-82 (2007) Article DOI: 10.1016/j.bmcl.2007.07.071 BindingDB Entry DOI: 10.7270/Q2VM4C0N
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50100973 (CHEMBL101605) Show SMILES Cc1cnc(NCCc2ccccn2)c(=O)n1CC(=O)NCc1ccc2[nH]ncc2c1 Show InChI InChI=1S/C8H7ClF3N3/c9-6-2-1-4(15-7(13)14)3-5(6)8(10,11)12/h1-3H,(H4,13,14,15)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	3.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50215308 (CHEMBL99185) Show SMILES Cc1ccc(NS(=O)(=O)c2ccc3OCCc3c2)c(=O)n1CC(=O)NCc1ccc2[nH]ncc2c1 Show InChI InChI=1S/C24H23N5O5S/c1-15-2-5-21(28-35(32,33)19-4-7-22-17(11-19)8-9-34-22)24(31)29(15)14-23(30)25-12-16-3-6-20-18(10-16)13-26-27-20/h2-7,10-11,13,28H,8-9,12,14H2,1H3,(H,25,30)(H,26,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	3.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50105480 (CHEMBL98194) Show SMILES Cc1cnc(NCC(F)(F)c2ccccc2)c(=O)n1CC(=O)NCc1ccc2[nH]nc(N)c2c1 Show InChI InChI=1S/C21H29NO/c23-17-7-8-18-16(12-17)13-20-19-6-1-2-9-21(18,19)10-11-22(20)14-15-4-3-5-15/h7-8,12,15,19-20,23H,1-6,9-11,13-14H2/t19-,20+,21?/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50215441 (CHEMBL101562) Show SMILES COc1ccc(CCNc2ncc(C)n(CC(=O)NCc3ccc4[nH]cnc4c3)c2=O)cc1 Show InChI InChI=1S/C24H26N6O3/c1-16-12-27-23(25-10-9-17-3-6-19(33-2)7-4-17)24(32)30(16)14-22(31)26-13-18-5-8-20-21(11-18)29-15-28-20/h3-8,11-12,15H,9-10,13-14H2,1-2H3,(H,25,27)(H,26,31)(H,28,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50100974 (CHEMBL317739) Show SMILES C[C@@H](CNc1ncc(C)n(CC(=O)NCc2ccc3[nH]ncc3c2)c1=O)c1ccccc1 Show InChI InChI=1S/C7H7Cl2N3/c8-4-1-5(9)3-6(2-4)12-7(10)11/h1-3H,(H4,10,11,12)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	5.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50215310 (CHEMBL97869) Show SMILES Cc1ccc(NS(=O)(=O)Cc2ccc(Cl)cc2)c(=O)n1CC(=O)NCc1ccc2[nH]cnc2c1 Show InChI InChI=1S/C23H22ClN5O4S/c1-15-2-8-20(28-34(32,33)13-16-3-6-18(24)7-4-16)23(31)29(15)12-22(30)25-11-17-5-9-19-21(10-17)27-14-26-19/h2-10,14,28H,11-13H2,1H3,(H,25,30)(H,26,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	6.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50221516 (6-methoxy-7-(3-morpholinopropoxy)-4-((1R,2S)-2-phe...) Show SMILES COc1cc2c(N[C@@H]3C[C@H]3c3ccccc3)c(cnc2cc1OCCCN1CCOCC1)C#N Show InChI InChI=1S/C27H30N4O3/c1-32-25-15-22-23(16-26(25)34-11-5-8-31-9-12-33-13-10-31)29-18-20(17-28)27(22)30-24-14-21(24)19-6-3-2-4-7-19/h2-4,6-7,15-16,18,21,24H,5,8-14H2,1H3,(H,29,30)/t21-,24+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tanabe Research Laboratories USA, Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant EGFR by fluorescence polarization assay				Bioorg Med Chem Lett 17: 5978-82 (2007) Article DOI: 10.1016/j.bmcl.2007.07.071 BindingDB Entry DOI: 10.7270/Q2VM4C0N
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50215311 (CHEMBL317140) Show SMILES COc1ccc(cc1)C1(CNc2ncc(C)n(CC(=O)NCc3ccc4[nH]nc(N)c4c3)c2=O)CC1 Show InChI InChI=1S/C26H29N7O3/c1-16-12-29-24(30-15-26(9-10-26)18-4-6-19(36-2)7-5-18)25(35)33(16)14-22(34)28-13-17-3-8-21-20(11-17)23(27)32-31-21/h3-8,11-12H,9-10,13-15H2,1-2H3,(H,28,34)(H,29,30)(H3,27,31,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50100975 (CHEMBL100838) Show SMILES C[C@H](CNc1ncc(C)n(CC(=O)NCc2ccc3[nH]cnc3c2)c1=O)c1ccccc1 Show InChI InChI=1S/C8H8Cl3N5/c9-4-1-3(2-5(10)6(4)11)15-8(14)16-7(12)13/h1-2H,(H6,12,13,14,15,16)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	9.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50215302 (CHEMBL98057) Show SMILES Cc1cnc(NCC2(CCC2)c2ccccc2)c(=O)n1CC(=O)NCc1ccc2[nH]nc(O)c2c1 Show InChI InChI=1S/C26H28N6O3/c1-17-13-28-23(29-16-26(10-5-11-26)19-6-3-2-4-7-19)25(35)32(17)15-22(33)27-14-18-8-9-21-20(12-18)24(34)31-30-21/h2-4,6-9,12-13H,5,10-11,14-16H2,1H3,(H,27,33)(H,28,29)(H2,30,31,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50216995 (CHEMBL319815) Show SMILES COc1cccc(CCNc2ncc(C)n(CC(=O)NCc3ccc4[nH]ncc4c3)c2=O)c1 Show InChI InChI=1S/C24H26N6O3/c1-16-12-27-23(25-9-8-17-4-3-5-20(11-17)33-2)24(32)30(16)15-22(31)26-13-18-6-7-21-19(10-18)14-28-29-21/h3-7,10-12,14H,8-9,13,15H2,1-2H3,(H,25,27)(H,26,31)(H,28,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50215304 (CHEMBL98212) Show SMILES Cc1cnc(NCC2(CC2)c2ccc(F)cc2)c(=O)n1CC(=O)NCc1ccc2[nH]nc(N)c2c1 Show InChI InChI=1S/C25H26FN7O2/c1-15-11-29-23(30-14-25(8-9-25)17-3-5-18(26)6-4-17)24(35)33(15)13-21(34)28-12-16-2-7-20-19(10-16)22(27)32-31-20/h2-7,10-11H,8-9,12-14H2,1H3,(H,28,34)(H,29,30)(H3,27,31,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50215317 (CHEMBL97950) Show SMILES Cc1cnc(NCC2(CC2)c2ccc(F)cc2)c(=O)n1CC(=O)NCc1ccc2c(N)noc2c1 Show InChI InChI=1S/C25H25FN6O3/c1-15-11-29-23(30-14-25(8-9-25)17-3-5-18(26)6-4-17)24(34)32(15)13-21(33)28-12-16-2-7-19-20(10-16)35-31-22(19)27/h2-7,10-11H,8-9,12-14H2,1H3,(H2,27,31)(H,28,33)(H,29,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50124087 (CHEMBL101563 | N-(1H-Benzoimidazol-5-ylmethyl)-2-(...) Show SMILES Cc1cnc(NCCc2ccccc2)c(=O)n1CC(=O)NCc1ccc2nc[nH]c2c1 Show InChI InChI=1S/C23H24N6O2/c1-16-12-26-22(24-10-9-17-5-3-2-4-6-17)23(31)29(16)14-21(30)25-13-18-7-8-19-20(11-18)28-15-27-19/h2-8,11-12,15H,9-10,13-14H2,1H3,(H,24,26)(H,25,30)(H,27,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	17	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50216992 (CHEMBL98859) Show SMILES Cc1cnc(NCCc2ccc(F)cc2)c(=O)n1CC(=O)NCc1ccc2c(N)noc2c1 Show InChI InChI=1S/C23H23FN6O3/c1-14-11-28-22(26-9-8-15-2-5-17(24)6-3-15)23(32)30(14)13-20(31)27-12-16-4-7-18-19(10-16)33-29-21(18)25/h2-7,10-11H,8-9,12-13H2,1H3,(H2,25,29)(H,26,28)(H,27,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	18	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50215318 (CHEMBL101613) Show SMILES Cc1cnc(NCCc2ccccc2)c(=O)n1CC(=O)NCc1ccc2[nH]ncc2c1 Show InChI InChI=1S/C23H24N6O2/c1-16-12-26-22(24-10-9-17-5-3-2-4-6-17)23(31)29(16)15-21(30)25-13-18-7-8-20-19(11-18)14-27-28-20/h2-8,11-12,14H,9-10,13,15H2,1H3,(H,24,26)(H,25,30)(H,27,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	18	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50215315 (CHEMBL100843) Show SMILES CCc1cnc(NCCc2ccccc2)c(=O)n1CC(=O)NCc1ccc2[nH]ccc2c1 Show InChI InChI=1S/C25H27N5O2/c1-2-21-16-29-24(27-12-10-18-6-4-3-5-7-18)25(32)30(21)17-23(31)28-15-19-8-9-22-20(14-19)11-13-26-22/h3-9,11,13-14,16,26H,2,10,12,15,17H2,1H3,(H,27,29)(H,28,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	24	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50221518 (6,7-dimethoxy-4-((1R,2S)-2-phenylcyclopropylamino)...) Show SMILES COc1cc2ncc(C#N)c(N[C@@H]3C[C@H]3c3ccccc3)c2cc1OC Show InChI InChI=1S/C21H19N3O2/c1-25-19-9-16-17(10-20(19)26-2)23-12-14(11-22)21(16)24-18-8-15(18)13-6-4-3-5-7-13/h3-7,9-10,12,15,18H,8H2,1-2H3,(H,23,24)/t15-,18+/m0/s1	PDB MMDB 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
Tanabe Research Laboratories USA, Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant EGFR by fluorescence polarization assay				Bioorg Med Chem Lett 17: 5978-82 (2007) Article DOI: 10.1016/j.bmcl.2007.07.071 BindingDB Entry DOI: 10.7270/Q2VM4C0N
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50215305 (CHEMBL100443) Show SMILES Cc1cnc(NCC2(CC2)c2ccccn2)c(=O)n1CC(=O)NCc1ccc2c(N)noc2c1 Show InChI InChI=1S/C24H25N7O3/c1-15-11-28-22(29-14-24(7-8-24)19-4-2-3-9-26-19)23(33)31(15)13-20(32)27-12-16-5-6-17-18(10-16)34-30-21(17)25/h2-6,9-11H,7-8,12-14H2,1H3,(H2,25,30)(H,27,32)(H,28,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	26	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50221531 (6-methoxy-7-(3-(4-methylpiperazin-1-yl)propoxy)-4-...) Show SMILES COc1cc2c(N[C@@H]3C[C@H]3c3ccccc3)c(cnc2cc1OCCCN1CCN(C)CC1)C#N Show InChI InChI=1S/C28H33N5O2/c1-32-10-12-33(13-11-32)9-6-14-35-27-17-24-23(16-26(27)34-2)28(21(18-29)19-30-24)31-25-15-22(25)20-7-4-3-5-8-20/h3-5,7-8,16-17,19,22,25H,6,9-15H2,1-2H3,(H,30,31)/t22-,25+/m0/s1	PDB MMDB 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
Tanabe Research Laboratories USA, Inc. Curated by ChEMBL					Assay Description Inhibition of SRC				Bioorg Med Chem Lett 17: 5978-82 (2007) Article DOI: 10.1016/j.bmcl.2007.07.071 BindingDB Entry DOI: 10.7270/Q2VM4C0N
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50215309 (CHEMBL102193) Show SMILES Cc1ccc(NS(=O)(=O)c2ccc3OCCc3c2)c(=O)n1CC(=O)NCc1ccc2[nH]nc(N)c2c1 Show InChI InChI=1S/C24H24N6O5S/c1-14-2-5-20(29-36(33,34)17-4-7-21-16(11-17)8-9-35-21)24(32)30(14)13-22(31)26-12-15-3-6-19-18(10-15)23(25)28-27-19/h2-7,10-11,29H,8-9,12-13H2,1H3,(H,26,31)(H3,25,27,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	29	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50100972 (CHEMBL98152) Show SMILES Cc1cnc(NCCc2ccc3CCCc3c2)c(=O)n1CC(=O)NCc1ccc2[nH]ccc2c1 Show InChI InChI=1S/C7H6Cl3N3/c8-4-1-3(13-7(11)12)2-5(9)6(4)10/h1-2H,(H4,11,12,13)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50215306 (CHEMBL100565) Show SMILES Cc1cnc(NCC(c2ccccc2)c2ccccc2)c(=O)n1CC(=O)NCc1ccc2c(N)noc2c1 Show InChI InChI=1S/C29H28N6O3/c1-19-15-32-28(33-17-24(21-8-4-2-5-9-21)22-10-6-3-7-11-22)29(37)35(19)18-26(36)31-16-20-12-13-23-25(14-20)38-34-27(23)30/h2-15,24H,16-18H2,1H3,(H2,30,34)(H,31,36)(H,32,33)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	31	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50215313 (CHEMBL101669) Show SMILES Cc1cnc(NCCc2ccccc2)c(=O)n1CC(=O)NCc1ccc2[nH]nc(O)c2c1 Show InChI InChI=1S/C23H24N6O3/c1-15-12-26-21(24-10-9-16-5-3-2-4-6-16)23(32)29(15)14-20(30)25-13-17-7-8-19-18(11-17)22(31)28-27-19/h2-8,11-12H,9-10,13-14H2,1H3,(H,24,26)(H,25,30)(H2,27,28,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	33	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50221535 (4-((1R,2S)-2-(2-fluorophenyl)cyclopropylamino)-6,7...) Show SMILES COc1cc2ncc(C#N)c(N[C@@H]3C[C@H]3c3ccccc3F)c2cc1OC Show InChI InChI=1S/C21H18FN3O2/c1-26-19-8-15-17(9-20(19)27-2)24-11-12(10-23)21(15)25-18-7-14(18)13-5-3-4-6-16(13)22/h3-6,8-9,11,14,18H,7H2,1-2H3,(H,24,25)/t14-,18+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	36	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tanabe Research Laboratories USA, Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant EGFR by fluorescence polarization assay				Bioorg Med Chem Lett 17: 5978-82 (2007) Article DOI: 10.1016/j.bmcl.2007.07.071 BindingDB Entry DOI: 10.7270/Q2VM4C0N
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50221522 (6-(4-(aminomethyl)phenyl)-4-((1R,2S)-2-phenylcyclo...) Show SMILES NCc1ccc(cc1)-c1ccc2ncc(C#N)c(N[C@@H]3C[C@H]3c3ccccc3)c2c1 Show InChI InChI=1S/C26H22N4/c27-14-17-6-8-18(9-7-17)20-10-11-24-23(12-20)26(21(15-28)16-29-24)30-25-13-22(25)19-4-2-1-3-5-19/h1-12,16,22,25H,13-14,27H2,(H,29,30)/t22-,25+/m0/s1	PDB MMDB 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
Tanabe Research Laboratories USA, Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant EGFR by fluorescence polarization assay				Bioorg Med Chem Lett 17: 5978-82 (2007) Article DOI: 10.1016/j.bmcl.2007.07.071 BindingDB Entry DOI: 10.7270/Q2VM4C0N
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Homo sapiens (Human))	BDBM50221531 (6-methoxy-7-(3-(4-methylpiperazin-1-yl)propoxy)-4-...) Show SMILES COc1cc2c(N[C@@H]3C[C@H]3c3ccccc3)c(cnc2cc1OCCCN1CCN(C)CC1)C#N Show InChI InChI=1S/C28H33N5O2/c1-32-10-12-33(13-11-32)9-6-14-35-27-17-24-23(16-26(27)34-2)28(21(18-29)19-30-24)31-25-15-22(25)20-7-4-3-5-8-20/h3-5,7-8,16-17,19,22,25H,6,9-15H2,1-2H3,(H,30,31)/t22-,25+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	41	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tanabe Research Laboratories USA, Inc. Curated by ChEMBL					Assay Description Inhibition of SYK				Bioorg Med Chem Lett 17: 5978-82 (2007) Article DOI: 10.1016/j.bmcl.2007.07.071 BindingDB Entry DOI: 10.7270/Q2VM4C0N
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50221531 (6-methoxy-7-(3-(4-methylpiperazin-1-yl)propoxy)-4-...) Show SMILES COc1cc2c(N[C@@H]3C[C@H]3c3ccccc3)c(cnc2cc1OCCCN1CCN(C)CC1)C#N Show InChI InChI=1S/C28H33N5O2/c1-32-10-12-33(13-11-32)9-6-14-35-27-17-24-23(16-26(27)34-2)28(21(18-29)19-30-24)31-25-15-22(25)20-7-4-3-5-8-20/h3-5,7-8,16-17,19,22,25H,6,9-15H2,1-2H3,(H,30,31)/t22-,25+/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
Tanabe Research Laboratories USA, Inc. Curated by ChEMBL					Assay Description Inhibition of ABL				Bioorg Med Chem Lett 17: 5978-82 (2007) Article DOI: 10.1016/j.bmcl.2007.07.071 BindingDB Entry DOI: 10.7270/Q2VM4C0N
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50221530 (6,7-diethyl-2-ethynyl-1-(((1S,2R)-2-p-tolylcyclopr...) Show SMILES COc1cc2ncc(C#N)c(N[C@@H]3C[C@H]3c3ccc(Cl)cc3)c2cc1OC Show InChI InChI=1S/C21H18ClN3O2/c1-26-19-8-16-17(9-20(19)27-2)24-11-13(10-23)21(16)25-18-7-15(18)12-3-5-14(22)6-4-12/h3-6,8-9,11,15,18H,7H2,1-2H3,(H,24,25)/t15-,18+/m0/s1	PDB MMDB 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
Tanabe Research Laboratories USA, Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant EGFR by fluorescence polarization assay				Bioorg Med Chem Lett 17: 5978-82 (2007) Article DOI: 10.1016/j.bmcl.2007.07.071 BindingDB Entry DOI: 10.7270/Q2VM4C0N
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50221516 (6-methoxy-7-(3-morpholinopropoxy)-4-((1R,2S)-2-phe...) Show SMILES COc1cc2c(N[C@@H]3C[C@H]3c3ccccc3)c(cnc2cc1OCCCN1CCOCC1)C#N Show InChI InChI=1S/C27H30N4O3/c1-32-25-15-22-23(16-26(25)34-11-5-8-31-9-12-33-13-10-31)29-18-20(17-28)27(22)30-24-14-21(24)19-6-3-2-4-7-19/h2-4,6-7,15-16,18,21,24H,5,8-14H2,1H3,(H,29,30)/t21-,24+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	45	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tanabe Research Laboratories USA, Inc. Curated by ChEMBL					Assay Description Inhibition of SRC				Bioorg Med Chem Lett 17: 5978-82 (2007) Article DOI: 10.1016/j.bmcl.2007.07.071 BindingDB Entry DOI: 10.7270/Q2VM4C0N
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50221524 (6-methoxy-4-((1R,2S)-2-phenylcyclopropylamino)-7-(...) Show SMILES COc1cc2c(N[C@@H]3C[C@H]3c3ccccc3)c(cnc2cc1OCCCc1cccnc1)C#N Show InChI InChI=1S/C28H26N4O2/c1-33-26-14-23-24(15-27(26)34-12-6-8-19-7-5-11-30-17-19)31-18-21(16-29)28(23)32-25-13-22(25)20-9-3-2-4-10-20/h2-5,7,9-11,14-15,17-18,22,25H,6,8,12-13H2,1H3,(H,31,32)/t22-,25+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	49	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tanabe Research Laboratories USA, Inc. Curated by ChEMBL					Assay Description Inhibition of SRC				Bioorg Med Chem Lett 17: 5978-82 (2007) Article DOI: 10.1016/j.bmcl.2007.07.071 BindingDB Entry DOI: 10.7270/Q2VM4C0N
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50221533 (4-((1R,2S)-2-(3-bromophenyl)cyclopropylamino)-6,7-...) Show SMILES COc1cc2ncc(C#N)c(N[C@@H]3C[C@H]3c3cccc(Br)c3)c2cc1OC Show InChI InChI=1S/C21H18BrN3O2/c1-26-19-8-16-17(9-20(19)27-2)24-11-13(10-23)21(16)25-18-7-15(18)12-4-3-5-14(22)6-12/h3-6,8-9,11,15,18H,7H2,1-2H3,(H,24,25)/t15-,18+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	52	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tanabe Research Laboratories USA, Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant EGFR by fluorescence polarization assay				Bioorg Med Chem Lett 17: 5978-82 (2007) Article DOI: 10.1016/j.bmcl.2007.07.071 BindingDB Entry DOI: 10.7270/Q2VM4C0N
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50221527 (7-methoxy-6-(3-morpholinopropoxy)-4-((1R,2S)-2-phe...) Show SMILES COc1cc2ncc(C#N)c(N[C@@H]3C[C@H]3c3ccccc3)c2cc1OCCCN1CCOCC1 Show InChI InChI=1S/C27H30N4O3/c1-32-25-16-23-22(15-26(25)34-11-5-8-31-9-12-33-13-10-31)27(20(17-28)18-29-23)30-24-14-21(24)19-6-3-2-4-7-19/h2-4,6-7,15-16,18,21,24H,5,8-14H2,1H3,(H,29,30)/t21-,24+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	52	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tanabe Research Laboratories USA, Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant EGFR by fluorescence polarization assay				Bioorg Med Chem Lett 17: 5978-82 (2007) Article DOI: 10.1016/j.bmcl.2007.07.071 BindingDB Entry DOI: 10.7270/Q2VM4C0N
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50221517 (6-methoxy-7-(2-methoxyethoxy)-4-((1R,2S)-2-phenylc...) Show SMILES COCCOc1cc2ncc(C#N)c(N[C@@H]3C[C@H]3c3ccccc3)c2cc1OC Show InChI InChI=1S/C23H23N3O3/c1-27-8-9-29-22-12-19-18(11-21(22)28-2)23(16(13-24)14-25-19)26-20-10-17(20)15-6-4-3-5-7-15/h3-7,11-12,14,17,20H,8-10H2,1-2H3,(H,25,26)/t17-,20+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tanabe Research Laboratories USA, Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant EGFR by fluorescence polarization assay				Bioorg Med Chem Lett 17: 5978-82 (2007) Article DOI: 10.1016/j.bmcl.2007.07.071 BindingDB Entry DOI: 10.7270/Q2VM4C0N
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50221521 (7-methoxy-6-(2-morpholinoethoxy)-4-((1R,2S)-2-phen...) Show SMILES COc1cc2ncc(C#N)c(N[C@@H]3C[C@H]3c3ccccc3)c2cc1OCCN1CCOCC1 Show InChI InChI=1S/C26H28N4O3/c1-31-24-15-22-21(14-25(24)33-12-9-30-7-10-32-11-8-30)26(19(16-27)17-28-22)29-23-13-20(23)18-5-3-2-4-6-18/h2-6,14-15,17,20,23H,7-13H2,1H3,(H,28,29)/t20-,23+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	64	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tanabe Research Laboratories USA, Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant EGFR by fluorescence polarization assay				Bioorg Med Chem Lett 17: 5978-82 (2007) Article DOI: 10.1016/j.bmcl.2007.07.071 BindingDB Entry DOI: 10.7270/Q2VM4C0N
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50221528 (7-methoxy-4-((1R,2S)-2-phenylcyclopropylamino)-6-(...) Show SMILES COc1cc2ncc(C#N)c(N[C@@H]3C[C@H]3c3ccccc3)c2cc1OCCCc1cccnc1 Show InChI InChI=1S/C28H26N4O2/c1-33-26-15-24-23(14-27(26)34-12-6-8-19-7-5-11-30-17-19)28(21(16-29)18-31-24)32-25-13-22(25)20-9-3-2-4-10-20/h2-5,7,9-11,14-15,17-18,22,25H,6,8,12-13H2,1H3,(H,31,32)/t22-,25+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	68	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tanabe Research Laboratories USA, Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant EGFR by fluorescence polarization assay				Bioorg Med Chem Lett 17: 5978-82 (2007) Article DOI: 10.1016/j.bmcl.2007.07.071 BindingDB Entry DOI: 10.7270/Q2VM4C0N
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50215442 (CHEMBL99116) Show SMILES Cc1ccc(NS(=O)(=O)Cc2ccccc2)c(=O)n1CC(=O)NCc1ccc2[nH]nc(N)c2c1 Show InChI InChI=1S/C23H24N6O4S/c1-15-7-9-20(28-34(32,33)14-16-5-3-2-4-6-16)23(31)29(15)13-21(30)25-12-17-8-10-19-18(11-17)22(24)27-26-19/h2-11,28H,12-14H2,1H3,(H,25,30)(H3,24,26,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	73	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50216994 (CHEMBL99206) Show SMILES Cc1ccc(NS(=O)(=O)Cc2ccccc2)c(=O)n1CC(=O)NCc1ccc2c(N)noc2c1 Show InChI InChI=1S/C23H23N5O5S/c1-15-7-10-19(27-34(31,32)14-16-5-3-2-4-6-16)23(30)28(15)13-21(29)25-12-17-8-9-18-20(11-17)33-26-22(18)24/h2-11,27H,12-14H2,1H3,(H2,24,26)(H,25,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	74	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50221529 (7-(4-(morpholinomethyl)phenyl)-4-((1R,2S)-2-phenyl...) Show SMILES N#Cc1cnc2cc(ccc2c1N[C@@H]1C[C@H]1c1ccccc1)-c1ccc(CN2CCOCC2)cc1 Show InChI InChI=1S/C30H28N4O/c31-18-25-19-32-28-16-24(22-8-6-21(7-9-22)20-34-12-14-35-15-13-34)10-11-26(28)30(25)33-29-17-27(29)23-4-2-1-3-5-23/h1-11,16,19,27,29H,12-15,17,20H2,(H,32,33)/t27-,29+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tanabe Research Laboratories USA, Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant EGFR by fluorescence polarization assay				Bioorg Med Chem Lett 17: 5978-82 (2007) Article DOI: 10.1016/j.bmcl.2007.07.071 BindingDB Entry DOI: 10.7270/Q2VM4C0N
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50221532 (6,7-dimethoxy-4-((1R,2S)-2-(4-phenoxyphenyl)cyclop...) Show SMILES COc1cc2ncc(C#N)c(N[C@@H]3C[C@H]3c3ccc(Oc4ccccc4)cc3)c2cc1OC Show InChI InChI=1S/C27H23N3O3/c1-31-25-13-22-23(14-26(25)32-2)29-16-18(15-28)27(22)30-24-12-21(24)17-8-10-20(11-9-17)33-19-6-4-3-5-7-19/h3-11,13-14,16,21,24H,12H2,1-2H3,(H,29,30)/t21-,24+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tanabe Research Laboratories USA, Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant EGFR by fluorescence polarization assay				Bioorg Med Chem Lett 17: 5978-82 (2007) Article DOI: 10.1016/j.bmcl.2007.07.071 BindingDB Entry DOI: 10.7270/Q2VM4C0N
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50215316 (CHEMBL98281) Show SMILES Cc1cnc(NCCc2ccccc2)c(=O)n1CC(=O)NCc1ccc2c(N)noc2c1 Show InChI InChI=1S/C23H24N6O3/c1-15-12-27-22(25-10-9-16-5-3-2-4-6-16)23(31)29(15)14-20(30)26-13-17-7-8-18-19(11-17)32-28-21(18)24/h2-8,11-12H,9-10,13-14H2,1H3,(H2,24,28)(H,25,27)(H,26,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	82	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50221522 (6-(4-(aminomethyl)phenyl)-4-((1R,2S)-2-phenylcyclo...) Show SMILES NCc1ccc(cc1)-c1ccc2ncc(C#N)c(N[C@@H]3C[C@H]3c3ccccc3)c2c1 Show InChI InChI=1S/C26H22N4/c27-14-17-6-8-18(9-7-17)20-10-11-24-23(12-20)26(21(15-28)16-29-24)30-25-13-22(25)19-4-2-1-3-5-19/h1-12,16,22,25H,13-14,27H2,(H,29,30)/t22-,25+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	86	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tanabe Research Laboratories USA, Inc. Curated by ChEMBL					Assay Description Inhibition of SRC				Bioorg Med Chem Lett 17: 5978-82 (2007) Article DOI: 10.1016/j.bmcl.2007.07.071 BindingDB Entry DOI: 10.7270/Q2VM4C0N
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50216991 (CHEMBL318472) Show SMILES Cc1cnc(NCCc2ccccc2)c(=O)n1CC(=O)NCc1ccc2[nH]nc(N)c2c1 Show InChI InChI=1S/C23H25N7O2/c1-15-12-27-22(25-10-9-16-5-3-2-4-6-16)23(32)30(15)14-20(31)26-13-17-7-8-19-18(11-17)21(24)29-28-19/h2-8,11-12H,9-10,13-14H2,1H3,(H,25,27)(H,26,31)(H3,24,28,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	89	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Thrombin (FIIa) cleavage of the chromogenic substrate				Bioorg Med Chem Lett 12: 2925-30 (2002) BindingDB Entry DOI: 10.7270/Q27946WJ
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50221524 (6-methoxy-4-((1R,2S)-2-phenylcyclopropylamino)-7-(...) Show SMILES COc1cc2c(N[C@@H]3C[C@H]3c3ccccc3)c(cnc2cc1OCCCc1cccnc1)C#N Show InChI InChI=1S/C28H26N4O2/c1-33-26-14-23-24(15-27(26)34-12-6-8-19-7-5-11-30-17-19)31-18-21(16-29)28(23)32-25-13-22(25)20-9-3-2-4-10-20/h2-5,7,9-11,14-15,17-18,22,25H,6,8,12-13H2,1H3,(H,31,32)/t22-,25+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	99	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tanabe Research Laboratories USA, Inc. Curated by ChEMBL					Assay Description Inhibition of KDR				Bioorg Med Chem Lett 17: 5978-82 (2007) Article DOI: 10.1016/j.bmcl.2007.07.071 BindingDB Entry DOI: 10.7270/Q2VM4C0N
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50221517 (6-methoxy-7-(2-methoxyethoxy)-4-((1R,2S)-2-phenylc...) Show SMILES COCCOc1cc2ncc(C#N)c(N[C@@H]3C[C@H]3c3ccccc3)c2cc1OC Show InChI InChI=1S/C23H23N3O3/c1-27-8-9-29-22-12-19-18(11-21(22)28-2)23(16(13-24)14-25-19)26-20-10-17(20)15-6-4-3-5-7-15/h3-7,11-12,14,17,20H,8-10H2,1-2H3,(H,25,26)/t17-,20+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	110	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tanabe Research Laboratories USA, Inc. Curated by ChEMBL					Assay Description Inhibition of SRC				Bioorg Med Chem Lett 17: 5978-82 (2007) Article DOI: 10.1016/j.bmcl.2007.07.071 BindingDB Entry DOI: 10.7270/Q2VM4C0N
					More data for this Ligand-Target Pair

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