Compile Data Set for Download or QSAR

Found 101 hits Enz. Inhib. hit(s) with all data for entry = 50047285   

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
Transient receptor potential cation channel subfamily A member 1 (Rattus norvegicus)	BDBM50157631 (CHEMBL3785736) Show SMILES Cn1cnc2ncn(Cc3nc(CCc4ccc(Cl)cc4)no3)c(=O)c12 Show InChI InChI=1S/C17H15ClN6O2/c1-23-9-19-16-15(23)17(25)24(10-20-16)8-14-21-13(22-26-14)7-4-11-2-5-12(18)6-3-11/h2-3,5-6,9-10H,4,7-8H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of hypo osm...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Homo sapiens (Human))	BDBM50157698 (CHEMBL3787249) Show SMILES Cc1ccnc2ncn(Cc3nc(CCc4ccc(Cl)cc4)no3)c(=O)c12 Show InChI InChI=1S/C19H16ClN5O2/c1-12-8-9-21-18-17(12)19(26)25(11-22-18)10-16-23-15(24-27-16)7-4-13-2-5-14(20)6-3-13/h2-3,5-6,8-9,11H,4,7,10H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at human TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-i...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Rattus norvegicus)	BDBM50157631 (CHEMBL3785736) Show SMILES Cn1cnc2ncn(Cc3nc(CCc4ccc(Cl)cc4)no3)c(=O)c12 Show InChI InChI=1S/C17H15ClN6O2/c1-23-9-19-16-15(23)17(25)24(10-20-16)8-14-21-13(22-26-14)7-4-11-2-5-12(18)6-3-11/h2-3,5-6,9-10H,4,7-8H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of methylgl...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Homo sapiens (Human))	BDBM50157631 (CHEMBL3785736) Show SMILES Cn1cnc2ncn(Cc3nc(CCc4ccc(Cl)cc4)no3)c(=O)c12 Show InChI InChI=1S/C17H15ClN6O2/c1-23-9-19-16-15(23)17(25)24(10-20-16)8-14-21-13(22-26-14)7-4-11-2-5-12(18)6-3-11/h2-3,5-6,9-10H,4,7-8H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at human TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-i...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Rattus norvegicus)	BDBM50157631 (CHEMBL3785736) Show SMILES Cn1cnc2ncn(Cc3nc(CCc4ccc(Cl)cc4)no3)c(=O)c12 Show InChI InChI=1S/C17H15ClN6O2/c1-23-9-19-16-15(23)17(25)24(10-20-16)8-14-21-13(22-26-14)7-4-11-2-5-12(18)6-3-11/h2-3,5-6,9-10H,4,7-8H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-ind...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Rattus norvegicus)	BDBM50157652 (CHEMBL3785110) Show SMILES Clc1ccc(CCc2noc(Cn3cnc4ncccc4c3=O)n2)cc1 Show InChI InChI=1S/C18H14ClN5O2/c19-13-6-3-12(4-7-13)5-8-15-22-16(26-23-15)10-24-11-21-17-14(18(24)25)2-1-9-20-17/h1-4,6-7,9,11H,5,8,10H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-ind...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Rattus norvegicus)	BDBM50157700 (CHEMBL3786037) Show SMILES Cn1ncc2ncn(Cc3nc(CCc4ccc(Cl)cc4)no3)c(=O)c12 Show InChI InChI=1S/C17H15ClN6O2/c1-23-16-13(8-20-23)19-10-24(17(16)25)9-15-21-14(22-26-15)7-4-11-2-5-12(18)6-3-11/h2-3,5-6,8,10H,4,7,9H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-ind...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Rattus norvegicus)	BDBM50157703 (CHEMBL3785133) Show SMILES FC(Cc1noc(Cn2cnc3ncccc3c2=O)n1)c1ccc(Cl)cc1 Show InChI InChI=1S/C18H13ClFN5O2/c19-12-5-3-11(4-6-12)14(20)8-15-23-16(27-24-15)9-25-10-22-17-13(18(25)26)2-1-7-21-17/h1-7,10,14H,8-9H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	31	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-ind...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Rattus norvegicus)	BDBM50157698 (CHEMBL3787249) Show SMILES Cc1ccnc2ncn(Cc3nc(CCc4ccc(Cl)cc4)no3)c(=O)c12 Show InChI InChI=1S/C19H16ClN5O2/c1-12-8-9-21-18-17(12)19(26)25(11-22-18)10-16-23-15(24-27-16)7-4-13-2-5-14(20)6-3-13/h2-3,5-6,8-9,11H,4,7,10H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	35	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-ind...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Homo sapiens (Human))	BDBM50157652 (CHEMBL3785110) Show SMILES Clc1ccc(CCc2noc(Cn3cnc4ncccc4c3=O)n2)cc1 Show InChI InChI=1S/C18H14ClN5O2/c19-13-6-3-12(4-7-13)5-8-15-22-16(26-23-15)10-24-11-21-17-14(18(24)25)2-1-9-20-17/h1-4,6-7,9,11H,5,8,10H2	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	41	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at human TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-i...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Homo sapiens (Human))	BDBM50157703 (CHEMBL3785133) Show SMILES FC(Cc1noc(Cn2cnc3ncccc3c2=O)n1)c1ccc(Cl)cc1 Show InChI InChI=1S/C18H13ClFN5O2/c19-12-5-3-11(4-6-12)14(20)8-15-23-16(27-24-15)9-25-10-22-17-13(18(25)26)2-1-7-21-17/h1-7,10,14H,8-9H2	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	41	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at human TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-i...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Homo sapiens (Human))	BDBM50157700 (CHEMBL3786037) Show SMILES Cn1ncc2ncn(Cc3nc(CCc4ccc(Cl)cc4)no3)c(=O)c12 Show InChI InChI=1S/C17H15ClN6O2/c1-23-16-13(8-20-23)19-10-24(17(16)25)9-15-21-14(22-26-15)7-4-11-2-5-12(18)6-3-11/h2-3,5-6,8,10H,4,7,9H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	52	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at human TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-i...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Rattus norvegicus)	BDBM50157707 (CHEMBL3787359) Show SMILES C\C(=C/c1nc(Cn2cnc3ncccc3c2=O)no1)c1ccc(Cl)cc1 Show InChI InChI=1S/C19H14ClN5O2/c1-12(13-4-6-14(20)7-5-13)9-17-23-16(24-27-17)10-25-11-22-18-15(19(25)26)3-2-8-21-18/h2-9,11H,10H2,1H3/b12-9+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	53	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-ind...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Rattus norvegicus)	BDBM50157709 (CHEMBL3786508) Show SMILES C\C(=C/c1noc(Cn2cnc3ncn(C)c3c2=O)n1)c1ccc(Cl)cc1 Show InChI InChI=1S/C18H15ClN6O2/c1-11(12-3-5-13(19)6-4-12)7-14-22-15(27-23-14)8-25-10-21-17-16(18(25)26)24(2)9-20-17/h3-7,9-10H,8H2,1-2H3/b11-7+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	55	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-ind...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Rattus norvegicus)	BDBM50157642 (CHEMBL3787289) Show SMILES Clc1ccc(CCNC(=O)Cn2cnc3c(cccc3c2=O)C#N)cc1 Show InChI InChI=1S/C19H15ClN4O2/c20-15-6-4-13(5-7-15)8-9-22-17(25)11-24-12-23-18-14(10-21)2-1-3-16(18)19(24)26/h1-7,12H,8-9,11H2,(H,22,25)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	56	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-ind...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Homo sapiens (Human))	BDBM50157702 (CHEMBL3786639 | JMC 2016, 59, 2794-2809, Example 3...) Show SMILES OC(Cc1noc(Cn2cnc3ncccc3c2=O)n1)c1ccc(Cl)cc1 Show InChI InChI=1S/C18H14ClN5O3/c19-12-5-3-11(4-6-12)14(25)8-15-22-16(27-23-15)9-24-10-21-17-13(18(24)26)2-1-7-20-17/h1-7,10,14,25H,8-9H2	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	58	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at human TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-i...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Homo sapiens (Human))	BDBM50157709 (CHEMBL3786508) Show SMILES C\C(=C/c1noc(Cn2cnc3ncn(C)c3c2=O)n1)c1ccc(Cl)cc1 Show InChI InChI=1S/C18H15ClN6O2/c1-11(12-3-5-13(19)6-4-12)7-14-22-15(27-23-14)8-25-10-21-17-16(18(25)26)24(2)9-20-17/h3-7,9-10H,8H2,1-2H3/b11-7+	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	63	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at human TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-i...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Homo sapiens (Human))	BDBM50157630 (CHEMBL3787125) Show SMILES Cc1cccc2ncn(CC(=O)NCCc3ccc(Cl)cc3)c(=O)c12 Show InChI InChI=1S/C19H18ClN3O2/c1-13-3-2-4-16-18(13)19(25)23(12-22-16)11-17(24)21-10-9-14-5-7-15(20)8-6-14/h2-8,12H,9-11H2,1H3,(H,21,24)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at human TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-i...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Rattus norvegicus)	BDBM50157631 (CHEMBL3785736) Show SMILES Cn1cnc2ncn(Cc3nc(CCc4ccc(Cl)cc4)no3)c(=O)c12 Show InChI InChI=1S/C17H15ClN6O2/c1-23-9-19-16-15(23)17(25)24(10-20-16)8-14-21-13(22-26-14)7-4-11-2-5-12(18)6-3-11/h2-3,5-6,9-10H,4,7-8H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	71	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-ind...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Homo sapiens (Human))	BDBM50157709 (CHEMBL3786508) Show SMILES C\C(=C/c1noc(Cn2cnc3ncn(C)c3c2=O)n1)c1ccc(Cl)cc1 Show InChI InChI=1S/C18H15ClN6O2/c1-11(12-3-5-13(19)6-4-12)7-14-22-15(27-23-14)8-25-10-21-17-16(18(25)26)24(2)9-20-17/h3-7,9-10H,8H2,1-2H3/b11-7+	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	71	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at human TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-i...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Rattus norvegicus)	BDBM50157709 (CHEMBL3786508) Show SMILES C\C(=C/c1noc(Cn2cnc3ncn(C)c3c2=O)n1)c1ccc(Cl)cc1 Show InChI InChI=1S/C18H15ClN6O2/c1-11(12-3-5-13(19)6-4-12)7-14-22-15(27-23-14)8-25-10-21-17-16(18(25)26)24(2)9-20-17/h3-7,9-10H,8H2,1-2H3/b11-7+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	75	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-ind...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Rattus norvegicus)	BDBM50157702 (CHEMBL3786639 | JMC 2016, 59, 2794-2809, Example 3...) Show SMILES OC(Cc1noc(Cn2cnc3ncccc3c2=O)n1)c1ccc(Cl)cc1 Show InChI InChI=1S/C18H14ClN5O3/c19-12-5-3-11(4-6-12)14(25)8-15-22-16(27-23-15)9-24-10-21-17-13(18(24)26)2-1-7-20-17/h1-7,10,14,25H,8-9H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	75	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-ind...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Homo sapiens (Human))	BDBM50157707 (CHEMBL3787359) Show SMILES C\C(=C/c1nc(Cn2cnc3ncccc3c2=O)no1)c1ccc(Cl)cc1 Show InChI InChI=1S/C19H14ClN5O2/c1-12(13-4-6-14(20)7-5-13)9-17-23-16(24-27-17)10-25-11-22-18-15(19(25)26)3-2-8-21-18/h2-9,11H,10H2,1H3/b12-9+	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	85	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at human TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-i...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Rattus norvegicus)	BDBM50157651 (CHEMBL3787566) Show SMILES Clc1ccc(CCc2nc(Cn3cnc4ncccc4c3=O)no2)cc1 Show InChI InChI=1S/C18H14ClN5O2/c19-13-6-3-12(4-7-13)5-8-16-22-15(23-26-16)10-24-11-21-17-14(18(24)25)2-1-9-20-17/h1-4,6-7,9,11H,5,8,10H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	89	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-ind...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Rattus norvegicus)	BDBM50157707 (CHEMBL3787359) Show SMILES C\C(=C/c1nc(Cn2cnc3ncccc3c2=O)no1)c1ccc(Cl)cc1 Show InChI InChI=1S/C19H14ClN5O2/c1-12(13-4-6-14(20)7-5-13)9-17-23-16(24-27-17)10-25-11-22-18-15(19(25)26)3-2-8-21-18/h2-9,11H,10H2,1H3/b12-9+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	105	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-ind...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Rattus norvegicus)	BDBM50157705 (CHEMBL3787353) Show SMILES CC(Cc1nc(Cn2cnc3ncccc3c2=O)no1)c1ccc(Cl)cc1 Show InChI InChI=1S/C19H16ClN5O2/c1-12(13-4-6-14(20)7-5-13)9-17-23-16(24-27-17)10-25-11-22-18-15(19(25)26)3-2-8-21-18/h2-8,11-12H,9-10H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	105	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-ind...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Rattus norvegicus)	BDBM50157630 (CHEMBL3787125) Show SMILES Cc1cccc2ncn(CC(=O)NCCc3ccc(Cl)cc3)c(=O)c12 Show InChI InChI=1S/C19H18ClN3O2/c1-13-3-2-4-16-18(13)19(25)23(12-22-16)11-17(24)21-10-9-14-5-7-15(20)8-6-14/h2-8,12H,9-11H2,1H3,(H,21,24)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	112	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-ind...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Rattus norvegicus)	BDBM50157696 (CHEMBL3786810) Show SMILES Clc1ccc(CCc2noc(Cn3cnc4ncncc4c3=O)n2)cc1 Show InChI InChI=1S/C17H13ClN6O2/c18-12-4-1-11(2-5-12)3-6-14-22-15(26-23-14)8-24-10-21-16-13(17(24)25)7-19-9-20-16/h1-2,4-5,7,9-10H,3,6,8H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	113	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-ind...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Homo sapiens (Human))	BDBM50157707 (CHEMBL3787359) Show SMILES C\C(=C/c1nc(Cn2cnc3ncccc3c2=O)no1)c1ccc(Cl)cc1 Show InChI InChI=1S/C19H14ClN5O2/c1-12(13-4-6-14(20)7-5-13)9-17-23-16(24-27-17)10-25-11-22-18-15(19(25)26)3-2-8-21-18/h2-9,11H,10H2,1H3/b12-9+	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	116	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at human TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-i...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Rattus norvegicus)	BDBM50157652 (CHEMBL3785110) Show SMILES Clc1ccc(CCc2noc(Cn3cnc4ncccc4c3=O)n2)cc1 Show InChI InChI=1S/C18H14ClN5O2/c19-13-6-3-12(4-7-13)5-8-15-22-16(26-23-15)10-24-11-21-17-14(18(24)25)2-1-9-20-17/h1-4,6-7,9,11H,5,8,10H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-ind...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Homo sapiens (Human))	BDBM50157631 (CHEMBL3785736) Show SMILES Cn1cnc2ncn(Cc3nc(CCc4ccc(Cl)cc4)no3)c(=O)c12 Show InChI InChI=1S/C17H15ClN6O2/c1-23-9-19-16-15(23)17(25)24(10-20-16)8-14-21-13(22-26-14)7-4-11-2-5-12(18)6-3-11/h2-3,5-6,9-10H,4,7-8H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	131	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at human TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-i...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Homo sapiens (Human))	BDBM50157695 (CHEMBL3785216) Show SMILES Clc1ccc(CCc2noc(Cn3cnc4nnccc4c3=O)n2)cc1 Show InChI InChI=1S/C17H13ClN6O2/c18-12-4-1-11(2-5-12)3-6-14-21-15(26-23-14)9-24-10-19-16-13(17(24)25)7-8-20-22-16/h1-2,4-5,7-8,10H,3,6,9H2	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	136	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at human TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-i...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Rattus norvegicus)	BDBM50157699 (CHEMBL3785390) Show SMILES Cn1cnc2ncn(Cc3noc(CCc4ccc(Cl)cc4)n3)c(=O)c12 Show InChI InChI=1S/C17H15ClN6O2/c1-23-9-19-16-15(23)17(25)24(10-20-16)8-13-21-14(26-22-13)7-4-11-2-5-12(18)6-3-11/h2-3,5-6,9-10H,4,7-8H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	136	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-ind...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Rattus norvegicus)	BDBM50157710 (CHEMBL3787204) Show SMILES Cc1cccc2c1ncn(CC(=O)NCCc1ccc(OC(F)F)cc1)c2=O Show InChI InChI=1S/C20H19F2N3O3/c1-13-3-2-4-16-18(13)24-12-25(19(16)27)11-17(26)23-10-9-14-5-7-15(8-6-14)28-20(21)22/h2-8,12,20H,9-11H2,1H3,(H,23,26)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	142	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-ind...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Homo sapiens (Human))	BDBM50157705 (CHEMBL3787353) Show SMILES CC(Cc1nc(Cn2cnc3ncccc3c2=O)no1)c1ccc(Cl)cc1 Show InChI InChI=1S/C19H16ClN5O2/c1-12(13-4-6-14(20)7-5-13)9-17-23-16(24-27-17)10-25-11-22-18-15(19(25)26)3-2-8-21-18/h2-8,11-12H,9-10H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at human TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-i...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Homo sapiens (Human))	BDBM50157696 (CHEMBL3786810) Show SMILES Clc1ccc(CCc2noc(Cn3cnc4ncncc4c3=O)n2)cc1 Show InChI InChI=1S/C17H13ClN6O2/c18-12-4-1-11(2-5-12)3-6-14-22-15(26-23-14)8-24-10-21-16-13(17(24)25)7-19-9-20-16/h1-2,4-5,7,9-10H,3,6,8H2	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	153	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at human TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-i...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Homo sapiens (Human))	BDBM50157651 (CHEMBL3787566) Show SMILES Clc1ccc(CCc2nc(Cn3cnc4ncccc4c3=O)no2)cc1 Show InChI InChI=1S/C18H14ClN5O2/c19-13-6-3-12(4-7-13)5-8-16-22-15(23-26-16)10-24-11-21-17-14(18(24)25)2-1-9-20-17/h1-4,6-7,9,11H,5,8,10H2	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	156	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at human TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-i...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Homo sapiens (Human))	BDBM50157708 (CHEMBL3786010) Show SMILES C\C(=C/c1nc(Cn2cnc3ncn(C)c3c2=O)no1)c1ccc(Cl)cc1 Show InChI InChI=1S/C18H15ClN6O2/c1-11(12-3-5-13(19)6-4-12)7-15-22-14(23-27-15)8-25-10-21-17-16(18(25)26)24(2)9-20-17/h3-7,9-10H,8H2,1-2H3/b11-7+	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	165	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at human TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-i...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Rattus norvegicus)	BDBM50157695 (CHEMBL3785216) Show SMILES Clc1ccc(CCc2noc(Cn3cnc4nnccc4c3=O)n2)cc1 Show InChI InChI=1S/C17H13ClN6O2/c18-12-4-1-11(2-5-12)3-6-14-21-15(26-23-14)9-24-10-19-16-13(17(24)25)7-8-20-22-16/h1-2,4-5,7-8,10H,3,6,9H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	176	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-ind...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Homo sapiens (Human))	BDBM50157642 (CHEMBL3787289) Show SMILES Clc1ccc(CCNC(=O)Cn2cnc3c(cccc3c2=O)C#N)cc1 Show InChI InChI=1S/C19H15ClN4O2/c20-15-6-4-13(5-7-15)8-9-22-17(25)11-24-12-23-18-14(10-21)2-1-3-16(18)19(24)26/h1-7,12H,8-9,11H2,(H,22,25)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	201	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at human TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-i...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Rattus norvegicus)	BDBM50157702 (CHEMBL3786639 | JMC 2016, 59, 2794-2809, Example 3...) Show SMILES OC(Cc1noc(Cn2cnc3ncccc3c2=O)n1)c1ccc(Cl)cc1 Show InChI InChI=1S/C18H14ClN5O3/c19-12-5-3-11(4-6-12)14(25)8-15-22-16(27-23-15)9-24-10-21-17-13(18(24)26)2-1-7-20-17/h1-7,10,14,25H,8-9H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	204	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-ind...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Homo sapiens (Human))	BDBM50157699 (CHEMBL3785390) Show SMILES Cn1cnc2ncn(Cc3noc(CCc4ccc(Cl)cc4)n3)c(=O)c12 Show InChI InChI=1S/C17H15ClN6O2/c1-23-9-19-16-15(23)17(25)24(10-20-16)8-13-21-14(26-22-13)7-4-11-2-5-12(18)6-3-11/h2-3,5-6,9-10H,4,7-8H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	211	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at human TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-i...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Homo sapiens (Human))	BDBM50157702 (CHEMBL3786639 | JMC 2016, 59, 2794-2809, Example 3...) Show SMILES OC(Cc1noc(Cn2cnc3ncccc3c2=O)n1)c1ccc(Cl)cc1 Show InChI InChI=1S/C18H14ClN5O3/c19-12-5-3-11(4-6-12)14(25)8-15-22-16(27-23-15)9-24-10-21-17-13(18(24)26)2-1-7-20-17/h1-7,10,14,25H,8-9H2	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	251	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at human TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-i...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Homo sapiens (Human))	BDBM50157629 (CHEMBL3786110) Show SMILES Cc1ccc2ncn(CC(=O)NCCc3ccc(Cl)cc3)c(=O)c2c1 Show InChI InChI=1S/C19H18ClN3O2/c1-13-2-7-17-16(10-13)19(25)23(12-22-17)11-18(24)21-9-8-14-3-5-15(20)6-4-14/h2-7,10,12H,8-9,11H2,1H3,(H,21,24)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	265	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at human TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-i...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Rattus norvegicus)	BDBM50157708 (CHEMBL3786010) Show SMILES C\C(=C/c1nc(Cn2cnc3ncn(C)c3c2=O)no1)c1ccc(Cl)cc1 Show InChI InChI=1S/C18H15ClN6O2/c1-11(12-3-5-13(19)6-4-12)7-15-22-14(23-27-15)8-25-10-21-17-16(18(25)26)24(2)9-20-17/h3-7,9-10H,8H2,1-2H3/b11-7+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	274	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-ind...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Homo sapiens (Human))	BDBM50157634 (CHEMBL3786619) Show SMILES FC(F)(F)c1cccc2c1ncn(CC(=O)NCCc1ccc(Cl)cc1)c2=O Show InChI InChI=1S/C19H15ClF3N3O2/c20-13-6-4-12(5-7-13)8-9-24-16(27)10-26-11-25-17-14(18(26)28)2-1-3-15(17)19(21,22)23/h1-7,11H,8-10H2,(H,24,27)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	286	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at human TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-i...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Rattus norvegicus)	BDBM50157629 (CHEMBL3786110) Show SMILES Cc1ccc2ncn(CC(=O)NCCc3ccc(Cl)cc3)c(=O)c2c1 Show InChI InChI=1S/C19H18ClN3O2/c1-13-2-7-17-16(10-13)19(25)23(12-22-17)11-18(24)21-9-8-14-3-5-15(20)6-4-14/h2-7,10,12H,8-9,11H2,1H3,(H,21,24)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	287	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-ind...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Rattus norvegicus)	BDBM50157634 (CHEMBL3786619) Show SMILES FC(F)(F)c1cccc2c1ncn(CC(=O)NCCc1ccc(Cl)cc1)c2=O Show InChI InChI=1S/C19H15ClF3N3O2/c20-13-6-4-12(5-7-13)8-9-24-16(27)10-26-11-25-17-14(18(26)28)2-1-3-15(17)19(21,22)23/h1-7,11H,8-10H2,(H,24,27)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	306	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-ind...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Rattus norvegicus)	BDBM50157697 (CHEMBL3786920) Show SMILES Clc1ccc(CCc2noc(Cn3cnc4nccnc4c3=O)n2)cc1 Show InChI InChI=1S/C17H13ClN6O2/c18-12-4-1-11(2-5-12)3-6-13-22-14(26-23-13)9-24-10-21-16-15(17(24)25)19-7-8-20-16/h1-2,4-5,7-8,10H,3,6,9H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	314	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-ind...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Rattus norvegicus)	BDBM50157624 (CHEMBL3787010) Show SMILES Cc1cccc2c1ncn(CC(=O)NCCc1ccc(Cl)cc1)c2=O Show InChI InChI=1S/C19H18ClN3O2/c1-13-3-2-4-16-18(13)22-12-23(19(16)25)11-17(24)21-10-9-14-5-7-15(20)8-6-14/h2-8,12H,9-11H2,1H3,(H,21,24)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	358	n/a	n/a	n/a	n/a	n/a	n/a
Amgen, Inc. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in tetracycline-inducible T-REx expression system transfected CHO cells assessed as inhibition of AITC-ind...				J Med Chem 59: 2794-809 (2016) Article DOI: 10.1021/acs.jmedchem.6b00039 BindingDB Entry DOI: 10.7270/Q2F47R17
					More data for this Ligand-Target Pair

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