Found 57 hits with Last Name = 'from' and Initial = 'r' 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
(Homo sapiens (Human)) | BDBM50390485
(CHEMBL2071601)Show SMILES CC(C)C(NC(=O)c1cc(Cl)ccc1C(F)(F)F)C(=O)c1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C19H16ClF3N2O4/c1-10(2)16(17(26)11-3-6-13(7-4-11)25(28)29)24-18(27)14-9-12(20)5-8-15(14)19(21,22)23/h3-10,16H,1-2H3,(H,24,27) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
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 |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Zn2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390479
(CHEMBL2071599)Show SMILES CC(C)c1onc(C)c1C(=O)NC(C(=O)c1ccc(C#N)c(F)c1)C(C)(C)C Show InChI InChI=1S/C21H24FN3O3/c1-11(2)18-16(12(3)25-28-18)20(27)24-19(21(4,5)6)17(26)13-7-8-14(10-23)15(22)9-13/h7-9,11,19H,1-6H3,(H,24,27) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Zn2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390478
(CHEMBL2071491)Show SMILES CC(C)C(NC(=O)c1ccccc1)C(=O)c1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C18H18N2O4/c1-12(2)16(19-18(22)14-6-4-3-5-7-14)17(21)13-8-10-15(11-9-13)20(23)24/h3-12,16H,1-2H3,(H,19,22) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 251 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Zn2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390463
(CHEMBL2071586)Show SMILES CC(C)C(NC(=O)N(C)C(C)(C)C)C(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C17H25ClN2O2/c1-11(2)14(19-16(22)20(6)17(3,4)5)15(21)12-7-9-13(18)10-8-12/h7-11,14H,1-6H3,(H,19,22) | 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 |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Ca2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390470
(CHEMBL2071507)Show SMILES CC(C)C(NC(=O)c1cc(Cl)ccc1C(F)(F)F)C(=O)c1ccc(cc1)C#N Show InChI InChI=1S/C20H16ClF3N2O2/c1-11(2)17(18(27)13-5-3-12(10-25)4-6-13)26-19(28)15-9-14(21)7-8-16(15)20(22,23)24/h3-9,11,17H,1-2H3,(H,26,28) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 316 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Zn2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390478
(CHEMBL2071491)Show SMILES CC(C)C(NC(=O)c1ccccc1)C(=O)c1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C18H18N2O4/c1-12(2)16(19-18(22)14-6-4-3-5-7-14)17(21)13-8-10-15(11-9-13)20(23)24/h3-12,16H,1-2H3,(H,19,22) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 316 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Ca2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390476
(CHEMBL2071494)Show InChI InChI=1S/C18H18ClNO2/c1-12(2)16(17(21)13-8-10-15(19)11-9-13)20-18(22)14-6-4-3-5-7-14/h3-12,16H,1-2H3,(H,20,22) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 398 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Zn2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390458
(CHEMBL2071592)Show InChI InChI=1S/C19H20ClNO2/c1-19(2,3)17(16(22)13-9-11-15(20)12-10-13)21-18(23)14-7-5-4-6-8-14/h4-12,17H,1-3H3,(H,21,23) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 398 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Zn2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390476
(CHEMBL2071494)Show InChI InChI=1S/C18H18ClNO2/c1-12(2)16(17(21)13-8-10-15(19)11-9-13)20-18(22)14-6-4-3-5-7-14/h3-12,16H,1-2H3,(H,20,22) | PDB
KEGG
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DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 398 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Zn2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390470
(CHEMBL2071507)Show SMILES CC(C)C(NC(=O)c1cc(Cl)ccc1C(F)(F)F)C(=O)c1ccc(cc1)C#N Show InChI InChI=1S/C20H16ClF3N2O2/c1-11(2)17(18(27)13-5-3-12(10-25)4-6-13)26-19(28)15-9-14(21)7-8-16(15)20(22,23)24/h3-9,11,17H,1-2H3,(H,26,28) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 398 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Ca2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390473
(CHEMBL2071502)Show SMILES CC(C)C(NC(=O)c1ccc(Cl)cc1)C(=O)c1ccc(cc1)C#N Show InChI InChI=1S/C19H17ClN2O2/c1-12(2)17(18(23)14-5-3-13(11-21)4-6-14)22-19(24)15-7-9-16(20)10-8-15/h3-10,12,17H,1-2H3,(H,22,24) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 398 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Ca2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390488
(CHEMBL2071600)Show SMILES CC(C)C(NC(=O)c1cnn(c1C(F)(F)F)C(C)(C)C)C(=O)c1ccc2nonc2c1 Show InChI InChI=1S/C20H22F3N5O3/c1-10(2)15(16(29)11-6-7-13-14(8-11)27-31-26-13)25-18(30)12-9-24-28(19(3,4)5)17(12)20(21,22)23/h6-10,15H,1-5H3,(H,25,30) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 398 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Zn2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390468
(CHEMBL2071509)Show SMILES CC(C)C(NC(=O)c1cnoc1C(C)(C)C)C(=O)c1ccc(cc1)C#N Show InChI InChI=1S/C20H23N3O3/c1-12(2)16(17(24)14-8-6-13(10-21)7-9-14)23-19(25)15-11-22-26-18(15)20(3,4)5/h6-9,11-12,16H,1-5H3,(H,23,25) | PDB
KEGG
UniProtKB/SwissProt
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antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 501 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Zn2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390463
(CHEMBL2071586)Show SMILES CC(C)C(NC(=O)N(C)C(C)(C)C)C(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C17H25ClN2O2/c1-11(2)14(19-16(22)20(6)17(3,4)5)15(21)12-7-9-13(18)10-8-12/h7-11,14H,1-6H3,(H,19,22) | PDB
KEGG
UniProtKB/SwissProt
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antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 631 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Zn2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390480
(CHEMBL2071588)Show InChI InChI=1S/C16H22ClNO3/c1-10(2)13(18-15(20)21-16(3,4)5)14(19)11-6-8-12(17)9-7-11/h6-10,13H,1-5H3,(H,18,20) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 794 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Zn2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390476
(CHEMBL2071494)Show InChI InChI=1S/C18H18ClNO2/c1-12(2)16(17(21)13-8-10-15(19)11-9-13)20-18(22)14-6-4-3-5-7-14/h3-12,16H,1-2H3,(H,20,22) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 999 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Ca2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390468
(CHEMBL2071509)Show SMILES CC(C)C(NC(=O)c1cnoc1C(C)(C)C)C(=O)c1ccc(cc1)C#N Show InChI InChI=1S/C20H23N3O3/c1-12(2)16(17(24)14-8-6-13(10-21)7-9-14)23-19(25)15-11-22-26-18(15)20(3,4)5/h6-9,11-12,16H,1-5H3,(H,23,25) | PDB
KEGG
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Ca2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390458
(CHEMBL2071592)Show InChI InChI=1S/C19H20ClNO2/c1-19(2,3)17(16(22)13-9-11-15(20)12-10-13)21-18(23)14-7-5-4-6-8-14/h4-12,17H,1-3H3,(H,21,23) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Ca2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390480
(CHEMBL2071588)Show InChI InChI=1S/C16H22ClNO3/c1-10(2)13(18-15(20)21-16(3,4)5)14(19)11-6-8-12(17)9-7-11/h6-10,13H,1-5H3,(H,18,20) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Ca2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390465
(CHEMBL2071513)Show InChI InChI=1S/C22H32N2O2/c1-4-5-6-7-8-9-10-11-20(25)24-21(17(2)3)22(26)19-14-12-18(16-23)13-15-19/h12-15,17,21H,4-11H2,1-3H3,(H,24,25) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Zn2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390476
(CHEMBL2071494)Show InChI InChI=1S/C18H18ClNO2/c1-12(2)16(17(21)13-8-10-15(19)11-9-13)20-18(22)14-6-4-3-5-7-14/h3-12,16H,1-2H3,(H,20,22) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Ca2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390475
(CHEMBL2071495)Show InChI InChI=1S/C18H18BrNO2/c1-12(2)16(17(21)13-8-10-15(19)11-9-13)20-18(22)14-6-4-3-5-7-14/h3-12,16H,1-2H3,(H,20,22) | PDB
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.26E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Zn2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390460
(CHEMBL2071590)Show SMILES CC(C)C(NC(=O)OC(C)(C)C)C(=O)c1ccc(C#N)c(F)c1 Show InChI InChI=1S/C17H21FN2O3/c1-10(2)14(20-16(22)23-17(3,4)5)15(21)11-6-7-12(9-19)13(18)8-11/h6-8,10,14H,1-5H3,(H,20,22) | PDB
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.26E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Ca2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390466
(CHEMBL2071511)Show SMILES CC(C)C(NC(=O)c1c(C)noc1C(C)C)C(=O)c1ccc(cc1)C#N Show InChI InChI=1S/C20H23N3O3/c1-11(2)17(18(24)15-8-6-14(10-21)7-9-15)22-20(25)16-13(5)23-26-19(16)12(3)4/h6-9,11-12,17H,1-5H3,(H,22,25) | PDB
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.58E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Ca2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390482
(CHEMBL2071512)Show SMILES CC(C)C(NC(=O)c1cc2ccccc2n1C)C(=O)c1ccc(cc1)C#N Show InChI InChI=1S/C22H21N3O2/c1-14(2)20(21(26)16-10-8-15(13-23)9-11-16)24-22(27)19-12-17-6-4-5-7-18(17)25(19)3/h4-12,14,20H,1-3H3,(H,24,27) | PDB
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.58E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Zn2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390460
(CHEMBL2071590)Show SMILES CC(C)C(NC(=O)OC(C)(C)C)C(=O)c1ccc(C#N)c(F)c1 Show InChI InChI=1S/C17H21FN2O3/c1-10(2)14(20-16(22)23-17(3,4)5)15(21)11-6-7-12(9-19)13(18)8-11/h6-8,10,14H,1-5H3,(H,20,22) | PDB
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Zn2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390466
(CHEMBL2071511)Show SMILES CC(C)C(NC(=O)c1c(C)noc1C(C)C)C(=O)c1ccc(cc1)C#N Show InChI InChI=1S/C20H23N3O3/c1-11(2)17(18(24)15-8-6-14(10-21)7-9-15)22-20(25)16-13(5)23-26-19(16)12(3)4/h6-9,11-12,17H,1-5H3,(H,22,25) | PDB
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Zn2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390457
(CHEMBL2071593)Show InChI InChI=1S/C18H16ClNO2/c19-15-10-8-13(9-11-15)17(21)16(12-6-7-12)20-18(22)14-4-2-1-3-5-14/h1-5,8-12,16H,6-7H2,(H,20,22) | PDB
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Ca2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390457
(CHEMBL2071593)Show InChI InChI=1S/C18H16ClNO2/c19-15-10-8-13(9-11-15)17(21)16(12-6-7-12)20-18(22)14-4-2-1-3-5-14/h1-5,8-12,16H,6-7H2,(H,20,22) | PDB
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Zn2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390462
(CHEMBL2071587)Show InChI InChI=1S/C16H23ClN2O2/c1-10(2)13(18-15(21)19-16(3,4)5)14(20)11-6-8-12(17)9-7-11/h6-10,13H,1-5H3,(H2,18,19,21) | PDB
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Ca2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390483
(CHEMBL2071506)Show SMILES CC(C)C(NC(=O)c1cc(Cl)ccc1F)C(=O)c1ccc(cc1)C#N Show InChI InChI=1S/C19H16ClFN2O2/c1-11(2)17(18(24)13-5-3-12(10-22)4-6-13)23-19(25)15-9-14(20)7-8-16(15)21/h3-9,11,17H,1-2H3,(H,23,25) | PDB
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Zn2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390465
(CHEMBL2071513)Show InChI InChI=1S/C22H32N2O2/c1-4-5-6-7-8-9-10-11-20(25)24-21(17(2)3)22(26)19-14-12-18(16-23)13-15-19/h12-15,17,21H,4-11H2,1-3H3,(H,24,25) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Ca2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390462
(CHEMBL2071587)Show InChI InChI=1S/C16H23ClN2O2/c1-10(2)13(18-15(21)19-16(3,4)5)14(20)11-6-8-12(17)9-7-11/h6-10,13H,1-5H3,(H2,18,19,21) | PDB
KEGG
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GoogleScholar
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.51E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Zn2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390471
(CHEMBL2071504)Show SMILES CC(C)C(NC(=O)c1ccc(Cl)cc1Cl)C(=O)c1ccc(cc1)C#N Show InChI InChI=1S/C19H16Cl2N2O2/c1-11(2)17(18(24)13-5-3-12(10-22)4-6-13)23-19(25)15-8-7-14(20)9-16(15)21/h3-9,11,17H,1-2H3,(H,23,25) | PDB
KEGG
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.51E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Zn2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390461
(CHEMBL2071589)Show InChI InChI=1S/C17H22N2O3/c1-11(2)14(19-16(21)22-17(3,4)5)15(20)13-8-6-12(10-18)7-9-13/h6-9,11,14H,1-5H3,(H,19,21) | PDB
KEGG
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GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.51E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Zn2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390486
(CHEMBL2071595)Show InChI InChI=1S/C19H20ClNO2/c1-13(2)19(3,17(22)14-9-11-16(20)12-10-14)21-18(23)15-7-5-4-6-8-15/h4-13H,1-3H3,(H,21,23) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.16E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Ca2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390484
(CHEMBL2071505)Show SMILES CC(C)C(NC(=O)c1ccc(Cl)cc1F)C(=O)c1ccc(cc1)C#N Show InChI InChI=1S/C19H16ClFN2O2/c1-11(2)17(18(24)13-5-3-12(10-22)4-6-13)23-19(25)15-8-7-14(20)9-16(15)21/h3-9,11,17H,1-2H3,(H,23,25) | PDB
KEGG
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DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.16E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Ca2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390469
(CHEMBL2071508)Show SMILES CC(C)C(NC(=O)c1ccccc1C(F)(F)F)C(=O)c1ccc(cc1)C#N Show InChI InChI=1S/C20H17F3N2O2/c1-12(2)17(18(26)14-9-7-13(11-24)8-10-14)25-19(27)15-5-3-4-6-16(15)20(21,22)23/h3-10,12,17H,1-2H3,(H,25,27) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.16E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Ca2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390474
(CHEMBL2071498)Show InChI InChI=1S/C19H18N2O2/c1-13(2)17(21-19(23)16-6-4-3-5-7-16)18(22)15-10-8-14(12-20)9-11-15/h3-11,13,17H,1-2H3,(H,21,23) | PDB
KEGG
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DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.98E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Ca2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390482
(CHEMBL2071512)Show SMILES CC(C)C(NC(=O)c1cc2ccccc2n1C)C(=O)c1ccc(cc1)C#N Show InChI InChI=1S/C22H21N3O2/c1-14(2)20(21(26)16-10-8-15(13-23)9-11-16)24-22(27)19-12-17-6-4-5-7-18(17)25(19)3/h4-12,14,20H,1-3H3,(H,24,27) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 3.98E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Ca2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390487
(CHEMBL2071497)Show SMILES CC(C)C(NC(=O)c1ccccc1)C(=O)c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C18H17Cl2NO2/c1-11(2)16(21-18(23)12-6-4-3-5-7-12)17(22)13-8-9-14(19)15(20)10-13/h3-11,16H,1-2H3,(H,21,23) | PDB
KEGG
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AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.98E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Ca2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390464
(CHEMBL2071585)Show SMILES CC(C)C(NC(=O)N(C)C(C)(C)C)C(=O)c1ccc(cc1)C#N Show InChI InChI=1S/C18H25N3O2/c1-12(2)15(20-17(23)21(6)18(3,4)5)16(22)14-9-7-13(11-19)8-10-14/h7-10,12,15H,1-6H3,(H,20,23) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 3.98E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Ca2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390467
(CHEMBL2071510)Show SMILES CC(C)C(NC(=O)c1c(C)noc1-c1ccccc1)C(=O)c1ccc(cc1)C#N Show InChI InChI=1S/C23H21N3O3/c1-14(2)20(21(27)17-11-9-16(13-24)10-12-17)25-23(28)19-15(3)26-29-22(19)18-7-5-4-6-8-18/h4-12,14,20H,1-3H3,(H,25,28) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 3.98E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Zn2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390484
(CHEMBL2071505)Show SMILES CC(C)C(NC(=O)c1ccc(Cl)cc1F)C(=O)c1ccc(cc1)C#N Show InChI InChI=1S/C19H16ClFN2O2/c1-11(2)17(18(24)13-5-3-12(10-22)4-6-13)23-19(25)15-8-7-14(20)9-16(15)21/h3-9,11,17H,1-2H3,(H,23,25) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.98E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Zn2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390469
(CHEMBL2071508)Show SMILES CC(C)C(NC(=O)c1ccccc1C(F)(F)F)C(=O)c1ccc(cc1)C#N Show InChI InChI=1S/C20H17F3N2O2/c1-12(2)17(18(26)14-9-7-13(11-24)8-10-14)25-19(27)15-5-3-4-6-16(15)20(21,22)23/h3-10,12,17H,1-2H3,(H,25,27) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.01E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Zn2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390459
(CHEMBL2071591)Show InChI InChI=1S/C15H21ClN2O3/c1-9(2)12(18-14(20)21-15(3,4)5)13(19)11-7-6-10(16)8-17-11/h6-9,12H,1-5H3,(H,18,20) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 5.01E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Ca2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390481
(CHEMBL2071584)Show SMILES CC(C)C(NC(=O)N1CCc2ccccc2C1)C(=O)c1ccc(cc1)C#N Show InChI InChI=1S/C22H23N3O2/c1-15(2)20(21(26)18-9-7-16(13-23)8-10-18)24-22(27)25-12-11-17-5-3-4-6-19(17)14-25/h3-10,15,20H,11-12,14H2,1-2H3,(H,24,27) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 5.01E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Ca2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390481
(CHEMBL2071584)Show SMILES CC(C)C(NC(=O)N1CCc2ccccc2C1)C(=O)c1ccc(cc1)C#N Show InChI InChI=1S/C22H23N3O2/c1-15(2)20(21(26)18-9-7-16(13-23)8-10-18)24-22(27)25-12-11-17-5-3-4-6-19(17)14-25/h3-10,15,20H,11-12,14H2,1-2H3,(H,24,27) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 5.01E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Zn2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390477
(CHEMBL2071493)Show InChI InChI=1S/C18H18FNO2/c1-12(2)16(17(21)13-8-10-15(19)11-9-13)20-18(22)14-6-4-3-5-7-14/h3-12,16H,1-2H3,(H,20,22) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.01E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Ca2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily A member 1
(Homo sapiens (Human)) | BDBM50390471
(CHEMBL2071504)Show SMILES CC(C)C(NC(=O)c1ccc(Cl)cc1Cl)C(=O)c1ccc(cc1)C#N Show InChI InChI=1S/C19H16Cl2N2O2/c1-11(2)17(18(24)13-5-3-12(10-22)4-6-13)23-19(25)15-8-7-14(20)9-16(15)21/h3-9,11,17H,1-2H3,(H,23,25) | PDB
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.01E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of Ca2+-induced intracellular calcium flux by FLIPR assay |
Bioorg Med Chem Lett 22: 5485-92 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.032
BindingDB Entry DOI: 10.7270/Q2RR20B8 |
More data for this
Ligand-Target Pair | |
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