Found 23 hits of Enzyme Inhibition Constant Data 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 |
|---|
Beta-3 adrenergic receptor
(Homo sapiens (Human)) | BDBM50409974
(CHEMBL371334)Show SMILES O[C@@H](CNCCc1ccc(NS(=O)(=O)c2ccc(Cc3nc(cs3)-c3cccnc3)cc2)cc1)c1ccccc1 Show InChI InChI=1S/C31H30N4O3S2/c36-30(25-5-2-1-3-6-25)21-33-18-16-23-8-12-27(13-9-23)35-40(37,38)28-14-10-24(11-15-28)19-31-34-29(22-39-31)26-7-4-17-32-20-26/h1-15,17,20,22,30,33,35-36H,16,18-19,21H2/t30-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 40 | n/a | n/a | n/a | n/a |
S.G.S.I.T.S.
Curated by ChEMBL
| Assay Description
Effective concentration to stimulate cAMP production in chinese hamster ovary cells expressing cloned human beta-3-adrenergic receptor |
Bioorg Med Chem Lett 15: 3167-73 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.119
BindingDB Entry DOI: 10.7270/Q26111JS |
More data for this
Ligand-Target Pair | |
Beta-3 adrenergic receptor
(Homo sapiens (Human)) | BDBM50409972
(CHEMBL435914)Show SMILES CCCCCCCCc1csc(CCc2ccc(cc2)S(=O)(=O)Nc2ccc(CCNC[C@H](O)c3ccccc3)cc2)n1 Show InChI InChI=1S/C35H45N3O3S2/c1-2-3-4-5-6-10-13-32-27-42-35(37-32)23-18-28-16-21-33(22-17-28)43(40,41)38-31-19-14-29(15-20-31)24-25-36-26-34(39)30-11-8-7-9-12-30/h7-9,11-12,14-17,19-22,27,34,36,38-39H,2-6,10,13,18,23-26H2,1H3/t34-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 9.80 | n/a | n/a | n/a | n/a |
S.G.S.I.T.S.
Curated by ChEMBL
| Assay Description
Effective concentration to stimulate cAMP production in chinese hamster ovary cells expressing cloned human beta-3-adrenergic receptor |
Bioorg Med Chem Lett 15: 3167-73 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.119
BindingDB Entry DOI: 10.7270/Q26111JS |
More data for this
Ligand-Target Pair | |
Beta-3 adrenergic receptor
(Homo sapiens (Human)) | BDBM50409969
(CHEMBL448158)Show SMILES O[C@@H](CNCCc1ccc(NS(=O)(=O)c2ccc(Cc3nc(Cc4ccc5ccccc5c4)cs3)cc2)cc1)c1ccccc1 Show InChI InChI=1S/C37H35N3O3S2/c41-36(31-7-2-1-3-8-31)25-38-21-20-27-11-16-33(17-12-27)40-45(42,43)35-18-13-28(14-19-35)24-37-39-34(26-44-37)23-29-10-15-30-6-4-5-9-32(30)22-29/h1-19,22,26,36,38,40-41H,20-21,23-25H2/t36-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 33 | n/a | n/a | n/a | n/a |
S.G.S.I.T.S.
Curated by ChEMBL
| Assay Description
Effective concentration to stimulate cAMP production in chinese hamster ovary cells expressing cloned human beta-3-adrenergic receptor |
Bioorg Med Chem Lett 15: 3167-73 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.119
BindingDB Entry DOI: 10.7270/Q26111JS |
More data for this
Ligand-Target Pair | |
Beta-3 adrenergic receptor
(Homo sapiens (Human)) | BDBM50409977
(CHEMBL195508)Show SMILES O[C@@H](CNCCc1ccc(NS(=O)(=O)c2ccc(Cc3nc(cs3)-c3cc4ccccc4o3)cc2)cc1)c1ccccc1 Show InChI InChI=1S/C34H31N3O4S2/c38-31(26-6-2-1-3-7-26)22-35-19-18-24-10-14-28(15-11-24)37-43(39,40)29-16-12-25(13-17-29)20-34-36-30(23-42-34)33-21-27-8-4-5-9-32(27)41-33/h1-17,21,23,31,35,37-38H,18-20,22H2/t31-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 5 | n/a | n/a | n/a | n/a |
S.G.S.I.T.S.
Curated by ChEMBL
| Assay Description
Effective concentration to stimulate cAMP production in chinese hamster ovary cells expressing cloned human beta-3-adrenergic receptor |
Bioorg Med Chem Lett 15: 3167-73 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.119
BindingDB Entry DOI: 10.7270/Q26111JS |
More data for this
Ligand-Target Pair | |
Beta-3 adrenergic receptor
(Homo sapiens (Human)) | BDBM50409980
(CHEMBL382962)Show SMILES O[C@@H](CNCCc1ccc(NS(=O)(=O)c2ccc(Cc3nc(cs3)-c3ccccn3)cc2)cc1)c1ccccc1 Show InChI InChI=1S/C31H30N4O3S2/c36-30(25-6-2-1-3-7-25)21-32-19-17-23-9-13-26(14-10-23)35-40(37,38)27-15-11-24(12-16-27)20-31-34-29(22-39-31)28-8-4-5-18-33-28/h1-16,18,22,30,32,35-36H,17,19-21H2/t30-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 22 | n/a | n/a | n/a | n/a |
S.G.S.I.T.S.
Curated by ChEMBL
| Assay Description
Effective concentration to stimulate cAMP production in chinese hamster ovary cells expressing cloned human beta-3-adrenergic receptor |
Bioorg Med Chem Lett 15: 3167-73 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.119
BindingDB Entry DOI: 10.7270/Q26111JS |
More data for this
Ligand-Target Pair | |
Beta-3 adrenergic receptor
(Homo sapiens (Human)) | BDBM50409971
(CHEMBL371641)Show SMILES CC(C)(C)c1ccc(cc1)-c1csc(Cc2ccc(cc2)S(=O)(=O)Nc2ccc(CCNC[C@H](O)c3ccccc3)cc2)n1 Show InChI InChI=1S/C36H39N3O3S2/c1-36(2,3)30-15-13-28(14-16-30)33-25-43-35(38-33)23-27-11-19-32(20-12-27)44(41,42)39-31-17-9-26(10-18-31)21-22-37-24-34(40)29-7-5-4-6-8-29/h4-20,25,34,37,39-40H,21-24H2,1-3H3/t34-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 2.40 | n/a | n/a | n/a | n/a |
S.G.S.I.T.S.
Curated by ChEMBL
| Assay Description
Effective concentration to stimulate cAMP production in chinese hamster ovary cells expressing cloned human beta-3-adrenergic receptor |
Bioorg Med Chem Lett 15: 3167-73 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.119
BindingDB Entry DOI: 10.7270/Q26111JS |
More data for this
Ligand-Target Pair | |
Beta-3 adrenergic receptor
(Homo sapiens (Human)) | BDBM50409973
(CHEMBL369939)Show SMILES O[C@@H](CNCCc1ccc(NS(=O)(=O)c2ccc(Cc3nc(Cc4ccc(F)cc4)cs3)cc2)cc1)c1ccccc1 Show InChI InChI=1S/C33H32FN3O3S2/c34-28-12-6-25(7-13-28)20-30-23-41-33(36-30)21-26-10-16-31(17-11-26)42(39,40)37-29-14-8-24(9-15-29)18-19-35-22-32(38)27-4-2-1-3-5-27/h1-17,23,32,35,37-38H,18-22H2/t32-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 6.20 | n/a | n/a | n/a | n/a |
S.G.S.I.T.S.
Curated by ChEMBL
| Assay Description
Effective concentration to stimulate cAMP production in chinese hamster ovary cells expressing cloned human beta-3-adrenergic receptor |
Bioorg Med Chem Lett 15: 3167-73 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.119
BindingDB Entry DOI: 10.7270/Q26111JS |
More data for this
Ligand-Target Pair | |
Beta-3 adrenergic receptor
(Homo sapiens (Human)) | BDBM50409975
(CHEMBL195409)Show SMILES O[C@@H](CNCCc1ccc(NS(=O)(=O)c2ccc(Cc3nc(cs3)-c3ccc(F)cc3)cc2)cc1)c1ccccc1 Show InChI InChI=1S/C32H30FN3O3S2/c33-27-12-10-25(11-13-27)30-22-40-32(35-30)20-24-8-16-29(17-9-24)41(38,39)36-28-14-6-23(7-15-28)18-19-34-21-31(37)26-4-2-1-3-5-26/h1-17,22,31,34,36-37H,18-21H2/t31-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 9.5 | n/a | n/a | n/a | n/a |
S.G.S.I.T.S.
Curated by ChEMBL
| Assay Description
Effective concentration to stimulate cAMP production in chinese hamster ovary cells expressing cloned human beta-3-adrenergic receptor |
Bioorg Med Chem Lett 15: 3167-73 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.119
BindingDB Entry DOI: 10.7270/Q26111JS |
More data for this
Ligand-Target Pair | |
Beta-3 adrenergic receptor
(Homo sapiens (Human)) | BDBM50409979
(CHEMBL194168)Show SMILES O[C@@H](CNCCc1ccc(NS(=O)(=O)c2ccc(Cc3nc(CCc4ccccc4)cs3)cc2)cc1)c1ccccc1 Show InChI InChI=1S/C34H35N3O3S2/c38-33(29-9-5-2-6-10-29)24-35-22-21-27-11-16-30(17-12-27)37-42(39,40)32-19-14-28(15-20-32)23-34-36-31(25-41-34)18-13-26-7-3-1-4-8-26/h1-12,14-17,19-20,25,33,35,37-38H,13,18,21-24H2/t33-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 33 | n/a | n/a | n/a | n/a |
S.G.S.I.T.S.
Curated by ChEMBL
| Assay Description
Effective concentration to stimulate cAMP production in chinese hamster ovary cells expressing cloned human beta-3-adrenergic receptor |
Bioorg Med Chem Lett 15: 3167-73 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.119
BindingDB Entry DOI: 10.7270/Q26111JS |
More data for this
Ligand-Target Pair | |
Beta-3 adrenergic receptor
(Homo sapiens (Human)) | BDBM50409983
(CHEMBL372056)Show SMILES O[C@@H](CNCCc1ccc(NS(=O)(=O)c2ccc(Cc3nc(cs3)-c3ccc(O)cc3)cc2)cc1)c1ccccc1 Show InChI InChI=1S/C32H31N3O4S2/c36-28-14-10-25(11-15-28)30-22-40-32(34-30)20-24-8-16-29(17-9-24)41(38,39)35-27-12-6-23(7-13-27)18-19-33-21-31(37)26-4-2-1-3-5-26/h1-17,22,31,33,35-37H,18-21H2/t31-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 45 | n/a | n/a | n/a | n/a |
S.G.S.I.T.S.
Curated by ChEMBL
| Assay Description
Effective concentration to stimulate cAMP production in chinese hamster ovary cells expressing cloned human beta-3-adrenergic receptor |
Bioorg Med Chem Lett 15: 3167-73 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.119
BindingDB Entry DOI: 10.7270/Q26111JS |
More data for this
Ligand-Target Pair | |
Beta-3 adrenergic receptor
(Homo sapiens (Human)) | BDBM50409985
(CHEMBL435134)Show SMILES CC(=O)Nc1ccc(cc1)-c1csc(Cc2ccc(cc2)S(=O)(=O)Nc2ccc(CCNC[C@H](O)c3ccccc3)cc2)n1 Show InChI InChI=1S/C34H34N4O4S2/c1-24(39)36-29-15-11-27(12-16-29)32-23-43-34(37-32)21-26-9-17-31(18-10-26)44(41,42)38-30-13-7-25(8-14-30)19-20-35-22-33(40)28-5-3-2-4-6-28/h2-18,23,33,35,38,40H,19-22H2,1H3,(H,36,39)/t33-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 45 | n/a | n/a | n/a | n/a |
S.G.S.I.T.S.
Curated by ChEMBL
| Assay Description
Effective concentration to stimulate cAMP production in chinese hamster ovary cells expressing cloned human beta-3-adrenergic receptor |
Bioorg Med Chem Lett 15: 3167-73 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.119
BindingDB Entry DOI: 10.7270/Q26111JS |
More data for this
Ligand-Target Pair | |
Beta-3 adrenergic receptor
(Homo sapiens (Human)) | BDBM50409967
(CHEMBL196081)Show SMILES O[C@@H](CNCCc1ccc(NS(=O)(=O)c2ccc(Cc3nc(cs3)-c3ccc(F)c(F)c3)cc2)cc1)c1ccccc1 Show InChI InChI=1S/C32H29F2N3O3S2/c33-28-15-10-25(19-29(28)34)30-21-41-32(36-30)18-23-8-13-27(14-9-23)42(39,40)37-26-11-6-22(7-12-26)16-17-35-20-31(38)24-4-2-1-3-5-24/h1-15,19,21,31,35,37-38H,16-18,20H2/t31-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 7.10 | n/a | n/a | n/a | n/a |
S.G.S.I.T.S.
Curated by ChEMBL
| Assay Description
Effective concentration to stimulate cAMP production in chinese hamster ovary cells expressing cloned human beta-3-adrenergic receptor |
Bioorg Med Chem Lett 15: 3167-73 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.119
BindingDB Entry DOI: 10.7270/Q26111JS |
More data for this
Ligand-Target Pair | |
Beta-3 adrenergic receptor
(Homo sapiens (Human)) | BDBM50409981
(CHEMBL371247)Show SMILES O[C@@H](CNCCc1ccc(NS(=O)(=O)c2ccc(CCc3nc(Cc4ccc5ccccc5c4)cs3)cc2)cc1)c1ccccc1 Show InChI InChI=1S/C38H37N3O3S2/c42-37(32-7-2-1-3-8-32)26-39-23-22-29-11-17-34(18-12-29)41-46(43,44)36-19-13-28(14-20-36)15-21-38-40-35(27-45-38)25-30-10-16-31-6-4-5-9-33(31)24-30/h1-14,16-20,24,27,37,39,41-42H,15,21-23,25-26H2/t37-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 12 | n/a | n/a | n/a | n/a |
S.G.S.I.T.S.
Curated by ChEMBL
| Assay Description
Effective concentration to stimulate cAMP production in chinese hamster ovary cells expressing cloned human beta-3-adrenergic receptor |
Bioorg Med Chem Lett 15: 3167-73 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.119
BindingDB Entry DOI: 10.7270/Q26111JS |
More data for this
Ligand-Target Pair | |
Beta-3 adrenergic receptor
(Homo sapiens (Human)) | BDBM50409963
(CHEMBL197364)Show SMILES O[C@@H](CNCCc1ccc(NS(=O)(=O)c2ccc(Cc3nc(cs3)-c3c[nH]c4ccccc34)cc2)cc1)c1ccccc1 Show InChI InChI=1S/C34H32N4O3S2/c39-33(26-6-2-1-3-7-26)22-35-19-18-24-10-14-27(15-11-24)38-43(40,41)28-16-12-25(13-17-28)20-34-37-32(23-42-34)30-21-36-31-9-5-4-8-29(30)31/h1-17,21,23,33,35-36,38-39H,18-20,22H2/t33-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 9.10 | n/a | n/a | n/a | n/a |
S.G.S.I.T.S.
Curated by ChEMBL
| Assay Description
Effective concentration to stimulate cAMP production in chinese hamster ovary cells expressing cloned human beta-3-adrenergic receptor |
Bioorg Med Chem Lett 15: 3167-73 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.119
BindingDB Entry DOI: 10.7270/Q26111JS |
More data for this
Ligand-Target Pair | |
Beta-3 adrenergic receptor
(Homo sapiens (Human)) | BDBM50409964
(CHEMBL371219)Show SMILES O[C@@H](CNCCc1ccc(NS(=O)(=O)c2ccc(Cc3nc(cs3)-c3cc4ccccc4s3)cc2)cc1)c1ccccc1 Show InChI InChI=1S/C34H31N3O3S3/c38-31(26-6-2-1-3-7-26)22-35-19-18-24-10-14-28(15-11-24)37-43(39,40)29-16-12-25(13-17-29)20-34-36-30(23-41-34)33-21-27-8-4-5-9-32(27)42-33/h1-17,21,23,31,35,37-38H,18-20,22H2/t31-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 5.80 | n/a | n/a | n/a | n/a |
S.G.S.I.T.S.
Curated by ChEMBL
| Assay Description
Effective concentration to stimulate cAMP production in chinese hamster ovary cells expressing cloned human beta-3-adrenergic receptor |
Bioorg Med Chem Lett 15: 3167-73 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.119
BindingDB Entry DOI: 10.7270/Q26111JS |
More data for this
Ligand-Target Pair | |
Beta-3 adrenergic receptor
(Homo sapiens (Human)) | BDBM50409978
(CHEMBL193410)Show SMILES O[C@@H](CNCCc1ccc(NS(=O)(=O)c2ccc(Cc3nc(cs3)-c3ccc4ncccc4c3)cc2)cc1)c1ccccc1 Show InChI InChI=1S/C35H32N4O3S2/c40-34(27-5-2-1-3-6-27)23-36-20-18-25-8-13-30(14-9-25)39-44(41,42)31-15-10-26(11-16-31)21-35-38-33(24-43-35)29-12-17-32-28(22-29)7-4-19-37-32/h1-17,19,22,24,34,36,39-40H,18,20-21,23H2/t34-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 2.70 | n/a | n/a | n/a | n/a |
S.G.S.I.T.S.
Curated by ChEMBL
| Assay Description
Effective concentration to stimulate cAMP production in chinese hamster ovary cells expressing cloned human beta-3-adrenergic receptor |
Bioorg Med Chem Lett 15: 3167-73 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.119
BindingDB Entry DOI: 10.7270/Q26111JS |
More data for this
Ligand-Target Pair | |
Beta-3 adrenergic receptor
(Homo sapiens (Human)) | BDBM50409965
(CHEMBL373188)Show SMILES CC(=O)NCCCCCc1csc(Cc2ccc(cc2)S(=O)(=O)Nc2ccc(CCNC[C@H](O)c3ccccc3)cc2)n1 Show InChI InChI=1S/C33H40N4O4S2/c1-25(38)35-20-7-3-6-10-30-24-42-33(36-30)22-27-13-17-31(18-14-27)43(40,41)37-29-15-11-26(12-16-29)19-21-34-23-32(39)28-8-4-2-5-9-28/h2,4-5,8-9,11-18,24,32,34,37,39H,3,6-7,10,19-23H2,1H3,(H,35,38)/t32-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 50 | n/a | n/a | n/a | n/a |
S.G.S.I.T.S.
Curated by ChEMBL
| Assay Description
Effective concentration to stimulate cAMP production in chinese hamster ovary cells expressing cloned human beta-3-adrenergic receptor |
Bioorg Med Chem Lett 15: 3167-73 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.119
BindingDB Entry DOI: 10.7270/Q26111JS |
More data for this
Ligand-Target Pair | |
Beta-3 adrenergic receptor
(Homo sapiens (Human)) | BDBM50409966
(CHEMBL383379)Show SMILES O[C@@H](CNCCc1ccc(NS(=O)(=O)c2ccc(Cc3nc(cs3)-c3ccc4ccccc4c3)cc2)cc1)c1ccccc1 Show InChI InChI=1S/C36H33N3O3S2/c40-35(29-7-2-1-3-8-29)24-37-21-20-26-10-16-32(17-11-26)39-44(41,42)33-18-12-27(13-19-33)22-36-38-34(25-43-36)31-15-14-28-6-4-5-9-30(28)23-31/h1-19,23,25,35,37,39-40H,20-22,24H2/t35-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 2 | n/a | n/a | n/a | n/a |
S.G.S.I.T.S.
Curated by ChEMBL
| Assay Description
Effective concentration to stimulate cAMP production in chinese hamster ovary cells expressing cloned human beta-3-adrenergic receptor |
Bioorg Med Chem Lett 15: 3167-73 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.119
BindingDB Entry DOI: 10.7270/Q26111JS |
More data for this
Ligand-Target Pair | |
Beta-3 adrenergic receptor
(Homo sapiens (Human)) | BDBM50409970
(CHEMBL370394)Show SMILES CC\C=C\CC\C=C\c1csc(Cc2ccc(cc2)S(=O)(=O)Nc2ccc(CCNC[C@H](O)c3ccccc3)cc2)n1 Show InChI InChI=1S/C34H39N3O3S2/c1-2-3-4-5-6-10-13-31-26-41-34(36-31)24-28-16-20-32(21-17-28)42(39,40)37-30-18-14-27(15-19-30)22-23-35-25-33(38)29-11-8-7-9-12-29/h3-4,7-21,26,33,35,37-38H,2,5-6,22-25H2,1H3/b4-3+,13-10+/t33-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 51 | n/a | n/a | n/a | n/a |
S.G.S.I.T.S.
Curated by ChEMBL
| Assay Description
Effective concentration to stimulate cAMP production in chinese hamster ovary cells expressing cloned human beta-3-adrenergic receptor |
Bioorg Med Chem Lett 15: 3167-73 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.119
BindingDB Entry DOI: 10.7270/Q26111JS |
More data for this
Ligand-Target Pair | |
Beta-3 adrenergic receptor
(Homo sapiens (Human)) | BDBM50409976
(CHEMBL193944)Show SMILES CCCCCCCCc1csc(Cc2ccc(cc2)S(=O)(=O)Nc2ccc(CCNC[C@H](O)c3ccccc3)cc2)n1 Show InChI InChI=1S/C34H43N3O3S2/c1-2-3-4-5-6-10-13-31-26-41-34(36-31)24-28-16-20-32(21-17-28)42(39,40)37-30-18-14-27(15-19-30)22-23-35-25-33(38)29-11-8-7-9-12-29/h7-9,11-12,14-21,26,33,35,37-38H,2-6,10,13,22-25H2,1H3/t33-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 10 | n/a | n/a | n/a | n/a |
S.G.S.I.T.S.
Curated by ChEMBL
| Assay Description
Effective concentration to stimulate cAMP production in chinese hamster ovary cells expressing cloned human beta-3-adrenergic receptor |
Bioorg Med Chem Lett 15: 3167-73 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.119
BindingDB Entry DOI: 10.7270/Q26111JS |
More data for this
Ligand-Target Pair | |
Beta-3 adrenergic receptor
(Homo sapiens (Human)) | BDBM50409982
(CHEMBL371220)Show SMILES O[C@@H](CNCCc1ccc(NS(=O)(=O)c2ccc(Cc3nc(cs3)-c3cnc4ccccc4c3)cc2)cc1)c1ccccc1 Show InChI InChI=1S/C35H32N4O3S2/c40-34(27-6-2-1-3-7-27)23-36-19-18-25-10-14-30(15-11-25)39-44(41,42)31-16-12-26(13-17-31)20-35-38-33(24-43-35)29-21-28-8-4-5-9-32(28)37-22-29/h1-17,21-22,24,34,36,39-40H,18-20,23H2/t34-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 7.30 | n/a | n/a | n/a | n/a |
S.G.S.I.T.S.
Curated by ChEMBL
| Assay Description
Effective concentration to stimulate cAMP production in chinese hamster ovary cells expressing cloned human beta-3-adrenergic receptor |
Bioorg Med Chem Lett 15: 3167-73 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.119
BindingDB Entry DOI: 10.7270/Q26111JS |
More data for this
Ligand-Target Pair | |
Beta-3 adrenergic receptor
(Homo sapiens (Human)) | BDBM50409984
(CHEMBL195400)Show SMILES O[C@@H](CNCCc1ccc(NS(=O)(=O)c2ccc(Cc3nc(CCC4CCCC4)cs3)cc2)cc1)c1ccccc1 Show InChI InChI=1S/C33H39N3O3S2/c37-32(28-8-2-1-3-9-28)23-34-21-20-26-10-15-29(16-11-26)36-41(38,39)31-18-13-27(14-19-31)22-33-35-30(24-40-33)17-12-25-6-4-5-7-25/h1-3,8-11,13-16,18-19,24-25,32,34,36-37H,4-7,12,17,20-23H2/t32-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 26 | n/a | n/a | n/a | n/a |
S.G.S.I.T.S.
Curated by ChEMBL
| Assay Description
Effective concentration to stimulate cAMP production in chinese hamster ovary cells expressing cloned human beta-3-adrenergic receptor |
Bioorg Med Chem Lett 15: 3167-73 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.119
BindingDB Entry DOI: 10.7270/Q26111JS |
More data for this
Ligand-Target Pair | |
Beta-3 adrenergic receptor
(Homo sapiens (Human)) | BDBM50409968
(CHEMBL371427)Show SMILES CCCCCCc1ccc(cc1)-c1csc(Cc2ccc(cc2)S(=O)(=O)Nc2ccc(CCNC[C@H](O)c3ccccc3)cc2)n1 Show InChI InChI=1S/C38H43N3O3S2/c1-2-3-4-6-9-29-12-18-32(19-13-29)36-28-45-38(40-36)26-31-16-22-35(23-17-31)46(43,44)41-34-20-14-30(15-21-34)24-25-39-27-37(42)33-10-7-5-8-11-33/h5,7-8,10-23,28,37,39,41-42H,2-4,6,9,24-27H2,1H3/t37-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.20 | n/a | n/a | n/a | n/a |
S.G.S.I.T.S.
Curated by ChEMBL
| Assay Description
Effective concentration to stimulate cAMP production in chinese hamster ovary cells expressing cloned human beta-3-adrenergic receptor |
Bioorg Med Chem Lett 15: 3167-73 (2005)
Article DOI: 10.1016/j.bmcl.2005.03.119
BindingDB Entry DOI: 10.7270/Q26111JS |
More data for this
Ligand-Target Pair | |
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