Found 274 hits with Last Name = 'horner' and Initial = 'm' 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 |
|---|
Sphingosine 1-phosphate receptor 1
(Homo sapiens (Human)) | BDBM23165
(CHEMBL366208 | FTY720-phosphate, (S)-2 | [(2S)-2-a...)Show SMILES CCCCCCCCc1ccc(CC[C@](N)(CO)COP(O)(O)=O)cc1 |r| Show InChI InChI=1S/C19H34NO5P/c1-2-3-4-5-6-7-8-17-9-11-18(12-10-17)13-14-19(20,15-21)16-25-26(22,23)24/h9-12,21H,2-8,13-16,20H2,1H3,(H2,22,23,24)/t19-/m0/s1 | PDB
Reactome pathway
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MCE
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| PDB
Article
PubMed
| n/a | n/a | 0.280 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Displacement of [33P]S1P from human S1P1R expressed in CHO cell membranes |
ACS Med Chem Lett 2: 97-101 (2011)
Article DOI: 10.1021/ml100227q
BindingDB Entry DOI: 10.7270/Q2WM1DP6 |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Sphingosine 1-phosphate receptor 1
(Homo sapiens (Human)) | BDBM22209
(1,2,4-oxadiazole based compound, 26 | 1-[(4-{5-[4-...)Show SMILES CC(C)Cc1ccc(cc1)-c1nc(no1)-c1ccc(CN2CC(C2)C(O)=O)cc1 Show InChI InChI=1S/C23H25N3O3/c1-15(2)11-16-3-9-19(10-4-16)22-24-21(25-29-22)18-7-5-17(6-8-18)12-26-13-20(14-26)23(27)28/h3-10,15,20H,11-14H2,1-2H3,(H,27,28) | PDB
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| n/a | n/a | 0.600 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Displacement of [33P]S1P from human S1P1R expressed in CHO cell membranes |
ACS Med Chem Lett 2: 97-101 (2011)
Article DOI: 10.1021/ml100227q
BindingDB Entry DOI: 10.7270/Q2WM1DP6 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Homo sapiens (Human)) | BDBM50463853
(CHEMBL4237618)Show SMILES Fc1cccnc1[C@@H](NC(=O)c1ccc(=O)[nH]c1)c1ccc(c(F)c1)C(F)(F)F |r| Show InChI InChI=1S/C19H12F5N3O2/c20-13-2-1-7-25-17(13)16(27-18(29)11-4-6-15(28)26-9-11)10-3-5-12(14(21)8-10)19(22,23)24/h1-9,16H,(H,26,28)(H,27,29)/t16-/m0/s1 | PDB
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| PC cid
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| Article
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| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Mus musculus) | BDBM50463844
(CHEMBL4247840)Show SMILES Oc1ccc(cc1)C(=O)N[C@@H](c1ccc(cc1)C(F)(F)F)c1ncccc1C(F)(F)F |r| Show InChI InChI=1S/C21H14F6N2O2/c22-20(23,24)14-7-3-12(4-8-14)17(18-16(21(25,26)27)2-1-11-28-18)29-19(31)13-5-9-15(30)10-6-13/h1-11,17,30H,(H,29,31)/t17-/m0/s1 | PDB
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| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at mouse TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Homo sapiens (Human)) | BDBM50463854
(CHEMBL4251427)Show SMILES FC(F)(F)c1ccc(cc1)[C@H](NC(=O)c1ccc(=O)[nH]c1)c1ncccc1C(F)(F)F |r| Show InChI InChI=1S/C20H13F6N3O2/c21-19(22,23)13-6-3-11(4-7-13)16(17-14(20(24,25)26)2-1-9-27-17)29-18(31)12-5-8-15(30)28-10-12/h1-10,16H,(H,28,30)(H,29,31)/t16-/m0/s1 | PDB
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| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 3
(Homo sapiens (Human)) | BDBM23165
(CHEMBL366208 | FTY720-phosphate, (S)-2 | [(2S)-2-a...)Show SMILES CCCCCCCCc1ccc(CC[C@](N)(CO)COP(O)(O)=O)cc1 |r| Show InChI InChI=1S/C19H34NO5P/c1-2-3-4-5-6-7-8-17-9-11-18(12-10-17)13-14-19(20,15-21)16-25-26(22,23)24/h9-12,21H,2-8,13-16,20H2,1H3,(H2,22,23,24)/t19-/m0/s1 | PDB
NCI pathway
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| PDB
Article
PubMed
| n/a | n/a | 6.30 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Displacement of [33P]S1P from human S1P3R expressed in CHO cell membranes |
ACS Med Chem Lett 2: 97-101 (2011)
Article DOI: 10.1021/ml100227q
BindingDB Entry DOI: 10.7270/Q2WM1DP6 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Transient receptor potential cation channel subfamily M member 8
(Rattus norvegicus (Rat)) | BDBM50463853
(CHEMBL4237618)Show SMILES Fc1cccnc1[C@@H](NC(=O)c1ccc(=O)[nH]c1)c1ccc(c(F)c1)C(F)(F)F |r| Show InChI InChI=1S/C19H12F5N3O2/c20-13-2-1-7-25-17(13)16(27-18(29)11-4-6-15(28)26-9-11)10-3-5-12(14(21)8-10)19(22,23)24/h1-9,16H,(H,26,28)(H,27,29)/t16-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at rat TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 mi... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Homo sapiens (Human)) | BDBM50463844
(CHEMBL4247840)Show SMILES Oc1ccc(cc1)C(=O)N[C@@H](c1ccc(cc1)C(F)(F)F)c1ncccc1C(F)(F)F |r| Show InChI InChI=1S/C21H14F6N2O2/c22-20(23,24)14-7-3-12(4-8-14)17(18-16(21(25,26)27)2-1-11-28-18)29-19(31)13-5-9-15(30)10-6-13/h1-11,17,30H,(H,29,31)/t17-/m0/s1 | PDB
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| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 1
(Homo sapiens (Human)) | BDBM22203
(1,2,4-oxadiazole based compound, 13 | 1-({4-[3-(4-...)Show SMILES CC(C)(C)c1ccc(cc1)-c1noc(n1)-c1ccc(CN2CC(C2)C(O)=O)cc1 Show InChI InChI=1S/C23H25N3O3/c1-23(2,3)19-10-8-16(9-11-19)20-24-21(29-25-20)17-6-4-15(5-7-17)12-26-13-18(14-26)22(27)28/h4-11,18H,12-14H2,1-3H3,(H,27,28) | PDB
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| PC cid
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| Article
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| n/a | n/a | 8.20 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Displacement of [33P]S1P from human S1P1R expressed in CHO cell membranes |
ACS Med Chem Lett 2: 97-101 (2011)
Article DOI: 10.1021/ml100227q
BindingDB Entry DOI: 10.7270/Q2WM1DP6 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Mus musculus) | BDBM50463846
(CHEMBL4243837)Show SMILES Fc1cccnc1[C@@H](NC(=O)c1ccc(=O)[nH]c1)c1ccc(OC(F)(F)F)c(F)c1 |r| Show InChI InChI=1S/C19H12F5N3O3/c20-12-2-1-7-25-17(12)16(27-18(29)11-4-6-15(28)26-9-11)10-3-5-14(13(21)8-10)30-19(22,23)24/h1-9,16H,(H,26,28)(H,27,29)/t16-/m0/s1 | PDB
Reactome pathway
KEGG
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| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at mouse TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Homo sapiens (Human)) | BDBM50463846
(CHEMBL4243837)Show SMILES Fc1cccnc1[C@@H](NC(=O)c1ccc(=O)[nH]c1)c1ccc(OC(F)(F)F)c(F)c1 |r| Show InChI InChI=1S/C19H12F5N3O3/c20-12-2-1-7-25-17(12)16(27-18(29)11-4-6-15(28)26-9-11)10-3-5-14(13(21)8-10)30-19(22,23)24/h1-9,16H,(H,26,28)(H,27,29)/t16-/m0/s1 | PDB
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| PC cid
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| Article
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| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 3
(Homo sapiens (Human)) | BDBM22203
(1,2,4-oxadiazole based compound, 13 | 1-({4-[3-(4-...)Show SMILES CC(C)(C)c1ccc(cc1)-c1noc(n1)-c1ccc(CN2CC(C2)C(O)=O)cc1 Show InChI InChI=1S/C23H25N3O3/c1-23(2,3)19-10-8-16(9-11-19)20-24-21(29-25-20)17-6-4-15(5-7-17)12-26-13-18(14-26)22(27)28/h4-11,18H,12-14H2,1-3H3,(H,27,28) | PDB
NCI pathway
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| PC cid
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| n/a | n/a | >10 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Displacement of [33P]S1P from human S1P3R expressed in CHO cell membranes |
ACS Med Chem Lett 2: 97-101 (2011)
Article DOI: 10.1021/ml100227q
BindingDB Entry DOI: 10.7270/Q2WM1DP6 |
More data for this
Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 3
(Homo sapiens (Human)) | BDBM22201
(1,3,4-oxadiazole based compound, 9 | 1-({4-[5-(4-t...)Show SMILES CC(C)(C)c1ccc(cc1)-c1nnc(o1)-c1ccc(CN2CC(C2)C(O)=O)cc1 Show InChI InChI=1S/C23H25N3O3/c1-23(2,3)19-10-8-17(9-11-19)21-25-24-20(29-21)16-6-4-15(5-7-16)12-26-13-18(14-26)22(27)28/h4-11,18H,12-14H2,1-3H3,(H,27,28) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
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| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | >10 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Displacement of [33P]S1P from human S1P3R expressed in CHO cell membranes |
ACS Med Chem Lett 2: 97-101 (2011)
Article DOI: 10.1021/ml100227q
BindingDB Entry DOI: 10.7270/Q2WM1DP6 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Homo sapiens (Human)) | BDBM50463863
(CHEMBL4251467)Show SMILES OC(=O)c1ccc(nc1)C(=O)N[C@@H](c1ccc(cc1)C(F)(F)F)c1ncccc1C(F)(F)F |r| Show InChI InChI=1S/C21H13F6N3O3/c22-20(23,24)13-6-3-11(4-7-13)16(17-14(21(25,26)27)2-1-9-28-17)30-18(31)15-8-5-12(10-29-15)19(32)33/h1-10,16H,(H,30,31)(H,32,33)/t16-/m0/s1 | PDB
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| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Homo sapiens (Human)) | BDBM50463855
(CHEMBL4248077)Show SMILES Fc1cccnc1[C@@H](NC(=O)c1ccc(=O)[nH]c1)c1ccc(cc1)C(F)(F)F |r| Show InChI InChI=1S/C19H13F4N3O2/c20-14-2-1-9-24-17(14)16(11-3-6-13(7-4-11)19(21,22)23)26-18(28)12-5-8-15(27)25-10-12/h1-10,16H,(H,25,27)(H,26,28)/t16-/m0/s1 | PDB
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| PC cid
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UniChem
| Article
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| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 3
(Homo sapiens (Human)) | BDBM50158345
(5-(4-phenyl-5-(trifluoromethyl)thiophen-2-yl)-3-(3...)Show SMILES FC(F)(F)c1sc(cc1-c1ccccc1)-c1nc(no1)-c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C20H10F6N2OS/c21-19(22,23)13-8-4-7-12(9-13)17-27-18(29-28-17)15-10-14(11-5-2-1-3-6-11)16(30-15)20(24,25)26/h1-10H | PDB
NCI pathway
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| Article
PubMed
| n/a | n/a | >10 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Displacement of [33P]S1P from human S1P3R expressed in CHO cell membranes |
ACS Med Chem Lett 2: 97-101 (2011)
Article DOI: 10.1021/ml100227q
BindingDB Entry DOI: 10.7270/Q2WM1DP6 |
More data for this
Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 3
(Homo sapiens (Human)) | BDBM22209
(1,2,4-oxadiazole based compound, 26 | 1-[(4-{5-[4-...)Show SMILES CC(C)Cc1ccc(cc1)-c1nc(no1)-c1ccc(CN2CC(C2)C(O)=O)cc1 Show InChI InChI=1S/C23H25N3O3/c1-15(2)11-16-3-9-19(10-4-16)22-24-21(25-29-22)18-7-5-17(6-8-18)12-26-13-20(14-26)23(27)28/h3-10,15,20H,11-14H2,1-2H3,(H,27,28) | PDB
NCI pathway
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| Article
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| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Displacement of [33P]S1P from human S1P3R expressed in CHO cell membranes |
ACS Med Chem Lett 2: 97-101 (2011)
Article DOI: 10.1021/ml100227q
BindingDB Entry DOI: 10.7270/Q2WM1DP6 |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Rattus norvegicus (Rat)) | BDBM50463846
(CHEMBL4243837)Show SMILES Fc1cccnc1[C@@H](NC(=O)c1ccc(=O)[nH]c1)c1ccc(OC(F)(F)F)c(F)c1 |r| Show InChI InChI=1S/C19H12F5N3O3/c20-12-2-1-7-25-17(12)16(27-18(29)11-4-6-15(28)26-9-11)10-3-5-14(13(21)8-10)30-19(22,23)24/h1-9,16H,(H,26,28)(H,27,29)/t16-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at rat TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 mi... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Rattus norvegicus (Rat)) | BDBM50463854
(CHEMBL4251427)Show SMILES FC(F)(F)c1ccc(cc1)[C@H](NC(=O)c1ccc(=O)[nH]c1)c1ncccc1C(F)(F)F |r| Show InChI InChI=1S/C20H13F6N3O2/c21-19(22,23)13-6-3-11(4-7-13)16(17-14(20(24,25)26)2-1-9-27-17)29-18(31)12-5-8-15(30)28-10-12/h1-10,16H,(H,28,30)(H,29,31)/t16-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at rat TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 mi... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Homo sapiens (Human)) | BDBM50463850
(CHEMBL4241349)Show SMILES OC(=O)c1ccc(nc1)C(=O)N[C@@H](c1ccc(OC(F)(F)F)c(F)c1)c1ncccc1F |r| Show InChI InChI=1S/C20H12F5N3O4/c21-12-2-1-7-26-17(12)16(10-4-6-15(13(22)8-10)32-20(23,24)25)28-18(29)14-5-3-11(9-27-14)19(30)31/h1-9,16H,(H,28,29)(H,30,31)/t16-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Rattus norvegicus (Rat)) | BDBM50463863
(CHEMBL4251467)Show SMILES OC(=O)c1ccc(nc1)C(=O)N[C@@H](c1ccc(cc1)C(F)(F)F)c1ncccc1C(F)(F)F |r| Show InChI InChI=1S/C21H13F6N3O3/c22-20(23,24)13-6-3-11(4-7-13)16(17-14(21(25,26)27)2-1-9-28-17)30-18(31)15-8-5-12(10-29-15)19(32)33/h1-10,16H,(H,30,31)(H,32,33)/t16-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at rat TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 mi... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Homo sapiens (Human)) | BDBM50463876
(CHEMBL4238921)Show SMILES COc1ccc(cn1)C(=O)N[C@@H](c1ccc(cc1)C(F)(F)F)c1ncccc1C(F)(F)F |r| Show InChI InChI=1S/C21H15F6N3O2/c1-32-16-9-6-13(11-29-16)19(31)30-17(12-4-7-14(8-5-12)20(22,23)24)18-15(21(25,26)27)3-2-10-28-18/h2-11,17H,1H3,(H,30,31)/t17-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Mus musculus) | BDBM50463855
(CHEMBL4248077)Show SMILES Fc1cccnc1[C@@H](NC(=O)c1ccc(=O)[nH]c1)c1ccc(cc1)C(F)(F)F |r| Show InChI InChI=1S/C19H13F4N3O2/c20-14-2-1-9-24-17(14)16(11-3-6-13(7-4-11)19(21,22)23)26-18(28)12-5-8-15(27)25-10-12/h1-10,16H,(H,25,27)(H,26,28)/t16-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at mouse TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Mus musculus) | BDBM50463863
(CHEMBL4251467)Show SMILES OC(=O)c1ccc(nc1)C(=O)N[C@@H](c1ccc(cc1)C(F)(F)F)c1ncccc1C(F)(F)F |r| Show InChI InChI=1S/C21H13F6N3O3/c22-20(23,24)13-6-3-11(4-7-13)16(17-14(21(25,26)27)2-1-9-28-17)30-18(31)15-8-5-12(10-29-15)19(32)33/h1-10,16H,(H,30,31)(H,32,33)/t16-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at mouse TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Homo sapiens (Human)) | BDBM50463859
(CHEMBL4245257)Show SMILES FC(F)(F)c1ccc(cc1)[C@H](NC(=O)c1ccc2cccnc2c1)c1ncccc1C(F)(F)F |r| Show InChI InChI=1S/C24H15F6N3O/c25-23(26,27)17-9-7-15(8-10-17)20(21-18(24(28,29)30)4-2-12-32-21)33-22(34)16-6-5-14-3-1-11-31-19(14)13-16/h1-13,20H,(H,33,34)/t20-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Homo sapiens (Human)) | BDBM50463858
(CHEMBL4246904)Show SMILES Fc1cc(ccc1C(F)(F)F)[C@H](NC(=O)c1ccc2cccnc2c1)c1ncccc1C(F)(F)F |r| Show InChI InChI=1S/C24H14F7N3O/c25-18-11-14(7-8-16(18)23(26,27)28)20(21-17(24(29,30)31)4-2-10-33-21)34-22(35)15-6-5-13-3-1-9-32-19(13)12-15/h1-12,20H,(H,34,35)/t20-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Homo sapiens (Human)) | BDBM50463862
(CHEMBL4248426)Show SMILES FC(F)(F)c1ccc(cc1)[C@H](NC(=O)c1ccc2ncccc2c1)c1ncccc1C(F)(F)F |r| Show InChI InChI=1S/C24H15F6N3O/c25-23(26,27)17-8-5-14(6-9-17)20(21-18(24(28,29)30)4-2-12-32-21)33-22(34)16-7-10-19-15(13-16)3-1-11-31-19/h1-13,20H,(H,33,34)/t20-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Rattus norvegicus (Rat)) | BDBM50463850
(CHEMBL4241349)Show SMILES OC(=O)c1ccc(nc1)C(=O)N[C@@H](c1ccc(OC(F)(F)F)c(F)c1)c1ncccc1F |r| Show InChI InChI=1S/C20H12F5N3O4/c21-12-2-1-7-26-17(12)16(10-4-6-15(13(22)8-10)32-20(23,24)25)28-18(29)14-5-3-11(9-27-14)19(30)31/h1-9,16H,(H,28,29)(H,30,31)/t16-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at rat TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 mi... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Homo sapiens (Human)) | BDBM50463849
(CHEMBL4250626)Show SMILES OC(=O)c1ccc(cc1)C(=O)N[C@@H](c1ccc(OC(F)(F)F)c(F)c1)c1ncccc1F |r| Show InChI InChI=1S/C21H13F5N2O4/c22-14-2-1-9-27-18(14)17(13-7-8-16(15(23)10-13)32-21(24,25)26)28-19(29)11-3-5-12(6-4-11)20(30)31/h1-10,17H,(H,28,29)(H,30,31)/t17-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Rattus norvegicus (Rat)) | BDBM50463855
(CHEMBL4248077)Show SMILES Fc1cccnc1[C@@H](NC(=O)c1ccc(=O)[nH]c1)c1ccc(cc1)C(F)(F)F |r| Show InChI InChI=1S/C19H13F4N3O2/c20-14-2-1-9-24-17(14)16(11-3-6-13(7-4-11)19(21,22)23)26-18(28)12-5-8-15(27)25-10-12/h1-10,16H,(H,25,27)(H,26,28)/t16-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at rat TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 mi... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Rattus norvegicus (Rat)) | BDBM50463844
(CHEMBL4247840)Show SMILES Oc1ccc(cc1)C(=O)N[C@@H](c1ccc(cc1)C(F)(F)F)c1ncccc1C(F)(F)F |r| Show InChI InChI=1S/C21H14F6N2O2/c22-20(23,24)14-7-3-12(4-8-14)17(18-16(21(25,26)27)2-1-11-28-18)29-19(31)13-5-9-15(30)10-6-13/h1-11,17,30H,(H,29,31)/t17-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at rat TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 mi... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Homo sapiens (Human)) | BDBM50463875
(CHEMBL4242867)Show SMILES FC(F)(F)Oc1ccc(cc1)[C@H](NC(=O)c1ccc2cccnc2c1)c1ncccc1C(F)(F)F |r| Show InChI InChI=1S/C24H15F6N3O2/c25-23(26,27)18-4-2-12-32-21(18)20(15-7-9-17(10-8-15)35-24(28,29)30)33-22(34)16-6-5-14-3-1-11-31-19(14)13-16/h1-13,20H,(H,33,34)/t20-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Mus musculus) | BDBM50463876
(CHEMBL4238921)Show SMILES COc1ccc(cn1)C(=O)N[C@@H](c1ccc(cc1)C(F)(F)F)c1ncccc1C(F)(F)F |r| Show InChI InChI=1S/C21H15F6N3O2/c1-32-16-9-6-13(11-29-16)19(31)30-17(12-4-7-14(8-5-12)20(22,23)24)18-15(21(25,26)27)3-2-10-28-18/h2-11,17H,1H3,(H,30,31)/t17-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at mouse TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Homo sapiens (Human)) | BDBM50463868
(CHEMBL4247268)Show SMILES FC(F)(F)c1ccc(cc1)[C@H](NC(=O)c1ccc(cc1)C#N)c1ncccc1C(F)(F)F |r| Show InChI InChI=1S/C22H13F6N3O/c23-21(24,25)16-9-7-14(8-10-16)18(19-17(22(26,27)28)2-1-11-30-19)31-20(32)15-5-3-13(12-29)4-6-15/h1-11,18H,(H,31,32)/t18-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Mus musculus) | BDBM50463854
(CHEMBL4251427)Show SMILES FC(F)(F)c1ccc(cc1)[C@H](NC(=O)c1ccc(=O)[nH]c1)c1ncccc1C(F)(F)F |r| Show InChI InChI=1S/C20H13F6N3O2/c21-19(22,23)13-6-3-11(4-7-13)16(17-14(20(24,25)26)2-1-9-27-17)29-18(31)12-5-8-15(30)28-10-12/h1-10,16H,(H,28,30)(H,29,31)/t16-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at mouse TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Homo sapiens (Human)) | BDBM50463856
(CHEMBL4247395)Show SMILES Fc1cc(ccc1C(F)(F)F)[C@H](NC(=O)c1ccccc1)c1ncccc1C(F)(F)F |r| Show InChI InChI=1S/C21H13F7N2O/c22-16-11-13(8-9-14(16)20(23,24)25)17(30-19(31)12-5-2-1-3-6-12)18-15(21(26,27)28)7-4-10-29-18/h1-11,17H,(H,30,31)/t17-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Rattus norvegicus (Rat)) | BDBM50463849
(CHEMBL4250626)Show SMILES OC(=O)c1ccc(cc1)C(=O)N[C@@H](c1ccc(OC(F)(F)F)c(F)c1)c1ncccc1F |r| Show InChI InChI=1S/C21H13F5N2O4/c22-14-2-1-9-27-18(14)17(13-7-8-16(15(23)10-13)32-21(24,25)26)28-19(29)11-3-5-12(6-4-11)20(30)31/h1-10,17H,(H,28,29)(H,30,31)/t17-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at rat TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 mi... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Rattus norvegicus (Rat)) | BDBM50463859
(CHEMBL4245257)Show SMILES FC(F)(F)c1ccc(cc1)[C@H](NC(=O)c1ccc2cccnc2c1)c1ncccc1C(F)(F)F |r| Show InChI InChI=1S/C24H15F6N3O/c25-23(26,27)17-9-7-15(8-10-17)20(21-18(24(28,29)30)4-2-12-32-21)33-22(34)16-6-5-14-3-1-11-31-19(14)13-16/h1-13,20H,(H,33,34)/t20-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at rat TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 mi... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Homo sapiens (Human)) | BDBM50463867
(CHEMBL4249999)Show SMILES FC(F)(F)c1ccc(cc1)[C@H](NC(=O)c1cccnc1)c1ncccc1C(F)(F)F |r| Show InChI InChI=1S/C20H13F6N3O/c21-19(22,23)14-7-5-12(6-8-14)16(29-18(30)13-3-1-9-27-11-13)17-15(20(24,25)26)4-2-10-28-17/h1-11,16H,(H,29,30)/t16-/m0/s1 | PDB
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| n/a | n/a | 35 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Sphingosine 1-phosphate receptor 1
(Homo sapiens (Human)) | BDBM50158345
(5-(4-phenyl-5-(trifluoromethyl)thiophen-2-yl)-3-(3...)Show SMILES FC(F)(F)c1sc(cc1-c1ccccc1)-c1nc(no1)-c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C20H10F6N2OS/c21-19(22,23)13-8-4-7-12(9-13)17-27-18(29-28-17)15-10-14(11-5-2-1-3-6-11)16(30-15)20(24,25)26/h1-10H | PDB
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| PDB
Article
PubMed
| n/a | n/a | 37 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Displacement of [33P]S1P from human S1P1R expressed in CHO cell membranes |
ACS Med Chem Lett 2: 97-101 (2011)
Article DOI: 10.1021/ml100227q
BindingDB Entry DOI: 10.7270/Q2WM1DP6 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Transient receptor potential cation channel subfamily M member 8
(Mus musculus) | BDBM50463868
(CHEMBL4247268)Show SMILES FC(F)(F)c1ccc(cc1)[C@H](NC(=O)c1ccc(cc1)C#N)c1ncccc1C(F)(F)F |r| Show InChI InChI=1S/C22H13F6N3O/c23-21(24,25)16-9-7-14(8-10-16)18(19-17(22(26,27)28)2-1-11-30-19)31-20(32)15-5-3-13(12-29)4-6-15/h1-11,18H,(H,31,32)/t18-/m0/s1 | PDB
Reactome pathway
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| n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at mouse TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Mus musculus) | BDBM50463856
(CHEMBL4247395)Show SMILES Fc1cc(ccc1C(F)(F)F)[C@H](NC(=O)c1ccccc1)c1ncccc1C(F)(F)F |r| Show InChI InChI=1S/C21H13F7N2O/c22-16-11-13(8-9-14(16)20(23,24)25)17(30-19(31)12-5-2-1-3-6-12)18-15(21(26,27)28)7-4-10-29-18/h1-11,17H,(H,30,31)/t17-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at mouse TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Mus musculus) | BDBM50463858
(CHEMBL4246904)Show SMILES Fc1cc(ccc1C(F)(F)F)[C@H](NC(=O)c1ccc2cccnc2c1)c1ncccc1C(F)(F)F |r| Show InChI InChI=1S/C24H14F7N3O/c25-18-11-14(7-8-16(18)23(26,27)28)20(21-17(24(29,30)31)4-2-10-33-21)34-22(35)15-6-5-13-3-1-9-32-19(13)12-15/h1-12,20H,(H,34,35)/t20-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at mouse TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Homo sapiens (Human)) | BDBM50463851
(CHEMBL4237740)Show SMILES C[C@H](NC(=O)N[C@@H](c1ccc(cc1)C(F)(F)F)c1ncccc1C(F)(F)F)C(F)(F)F |r| Show InChI InChI=1S/C18H14F9N3O/c1-9(16(19,20)21)29-15(31)30-13(10-4-6-11(7-5-10)17(22,23)24)14-12(18(25,26)27)3-2-8-28-14/h2-9,13H,1H3,(H2,29,30,31)/t9-,13-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Mus musculus) | BDBM50463859
(CHEMBL4245257)Show SMILES FC(F)(F)c1ccc(cc1)[C@H](NC(=O)c1ccc2cccnc2c1)c1ncccc1C(F)(F)F |r| Show InChI InChI=1S/C24H15F6N3O/c25-23(26,27)17-9-7-15(8-10-17)20(21-18(24(28,29)30)4-2-12-32-21)33-22(34)16-6-5-14-3-1-11-31-19(14)13-16/h1-13,20H,(H,33,34)/t20-/m0/s1 | PDB
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| n/a | n/a | 53 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at mouse TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Mus musculus) | BDBM50463867
(CHEMBL4249999)Show SMILES FC(F)(F)c1ccc(cc1)[C@H](NC(=O)c1cccnc1)c1ncccc1C(F)(F)F |r| Show InChI InChI=1S/C20H13F6N3O/c21-19(22,23)14-7-5-12(6-8-14)16(29-18(30)13-3-1-9-27-11-13)17-15(20(24,25)26)4-2-10-28-17/h1-11,16H,(H,29,30)/t16-/m0/s1 | PDB
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| n/a | n/a | 54 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at mouse TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Homo sapiens (Human)) | BDBM50463865
(CHEMBL4244629)Show SMILES C[C@H](NC(=O)N[C@@H](c1ccc(cc1)C(F)(F)F)c1ncccc1Br)C(F)(F)F |r| Show InChI InChI=1S/C17H14BrF6N3O/c1-9(16(19,20)21)26-15(28)27-13(14-12(18)3-2-8-25-14)10-4-6-11(7-5-10)17(22,23)24/h2-9,13H,1H3,(H2,26,27,28)/t9-,13-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Mus musculus) | BDBM50463875
(CHEMBL4242867)Show SMILES FC(F)(F)Oc1ccc(cc1)[C@H](NC(=O)c1ccc2cccnc2c1)c1ncccc1C(F)(F)F |r| Show InChI InChI=1S/C24H15F6N3O2/c25-23(26,27)18-4-2-12-32-21(18)20(15-7-9-17(10-8-15)35-24(28,29)30)33-22(34)16-6-5-14-3-1-11-31-19(14)13-16/h1-13,20H,(H,33,34)/t20-/m0/s1 | PDB
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| n/a | n/a | 67 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at mouse TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Homo sapiens (Human)) | BDBM50463872
(CHEMBL4246304)Show SMILES FC(F)(F)c1cccnc1[C@@H](NC(=O)c1ccc2cccnc2c1)c1cnc2ccccc2c1 |r| Show InChI InChI=1S/C26H17F3N4O/c27-26(28,29)20-7-4-12-31-24(20)23(19-13-17-5-1-2-8-21(17)32-15-19)33-25(34)18-10-9-16-6-3-11-30-22(16)14-18/h1-15,23H,(H,33,34)/t23-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily M member 8
(Homo sapiens (Human)) | BDBM50463848
(CHEMBL4245611)Show SMILES Cc1ccc(cc1)[C@H](NC(=O)c1ccc2cccnc2c1)c1ncccc1C(F)(F)F |r| Show InChI InChI=1S/C24H18F3N3O/c1-15-6-8-17(9-7-15)21(22-19(24(25,26)27)5-3-13-29-22)30-23(31)18-11-10-16-4-2-12-28-20(16)14-18/h2-14,21H,1H3,(H,30,31)/t21-/m0/s1 | PDB
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TBA
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPM8 expressed in CHO cells assessed as inhibition of icilin-induced intracellular calcium levels preincubated for 2.5 ... |
J Med Chem 61: 8186-8201 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00518
BindingDB Entry DOI: 10.7270/Q2TH8QCW |
More data for this
Ligand-Target Pair | |
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