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Found 8 hits Enz. Inhib. hit(s) with Target = 'G protein-coupled receptor 39-1b' AND taxid = 10116   
Target
(Institution)
LigandTarget
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
pHTemp
°C
G protein-coupled receptor 39-1b


(Rattus norvegicus)
BDBM50030788
PNG
(CHEMBL3342358)
Show SMILES CNc1nc(NCc2ccc(NS(C)(=O)=O)cc2Cl)cc(n1)-c1ccccn1
Show InChI InChI=1S/C18H19ClN6O2S/c1-20-18-23-16(15-5-3-4-8-21-15)10-17(24-18)22-11-12-6-7-13(9-14(12)19)25-28(2,26)27/h3-10,25H,11H2,1-2H3,(H2,20,22,23,24)
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PubMed
n/an/an/an/a 0.400n/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Agonist activity at rat GPR39 by IP1 assay


Citation and Details
More data for this
Ligand-Target Pair
G protein-coupled receptor 39-1b


(Rattus norvegicus)
BDBM50030789
PNG
(CHEMBL3341764)
Show SMILES Fc1cccc(c1)S(=O)(=O)NC[C@H]1CC[C@H](CNc2cc(nc(NC3CC3)n2)-c2ccccn2)CC1
Show InChI InChI=1/C26H31FN6O2S/c27-20-4-3-5-22(14-20)36(34,35)30-17-19-9-7-18(8-10-19)16-29-25-15-24(23-6-1-2-13-28-23)32-26(33-25)31-21-11-12-21/h1-6,13-15,18-19,21,30H,7-12,16-17H2,(H2,29,31,32,33)/t18-,19-
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n/an/an/an/a 1n/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Agonist activity at rat GPR39 by IP1 assay


Citation and Details
More data for this
Ligand-Target Pair
G protein-coupled receptor 39-1b


(Rattus norvegicus)
BDBM50030790
PNG
(CHEMBL3342357)
Show SMILES Fc1cccc(c1)S(=O)(=O)NC[C@H]1CC[C@H](CNc2nc(NC3CC3)cc(n2)-c2ccccn2)CC1
Show InChI InChI=1/C26H31FN6O2S/c27-20-4-3-5-22(14-20)36(34,35)30-17-19-9-7-18(8-10-19)16-29-26-32-24(23-6-1-2-13-28-23)15-25(33-26)31-21-11-12-21/h1-6,13-15,18-19,21,30H,7-12,16-17H2,(H2,29,31,32,33)/t18-,19-
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n/an/an/an/a 12n/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Agonist activity at rat GPR39 by IP1 assay


Citation and Details
More data for this
Ligand-Target Pair
G protein-coupled receptor 39-1b


(Rattus norvegicus)
BDBM16
PNG
(Zn2+ | zinc(2+) ion)
Show InChI InChI=1S/Zn/q+2
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n/an/an/an/a 4.04E+3n/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Agonist activity at rat GPR39 expressed in HEK293 cells by IP1 assay


Citation and Details
More data for this
Ligand-Target Pair
G protein-coupled receptor 39-1b


(Rattus norvegicus)
BDBM50030777
PNG
(CHEMBL3342376)
Show SMILES CNc1nc(NCc2ccc(NS(C)(=O)=O)cc2)cc(n1)-c1ccccn1
Show InChI InChI=1S/C18H20N6O2S/c1-19-18-22-16(15-5-3-4-10-20-15)11-17(23-18)21-12-13-6-8-14(9-7-13)24-27(2,25)26/h3-11,24H,12H2,1-2H3,(H2,19,21,22,23)
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n/an/an/an/a 3n/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Agonist activity at rat GPR39 expressed in HEK293 cells by IP1 assay


Citation and Details
More data for this
Ligand-Target Pair
G protein-coupled receptor 39-1b


(Rattus norvegicus)
BDBM50030776
PNG
(CHEMBL3342377)
Show SMILES CNc1nc(NCc2ccc(NC(C)=O)cc2)cc(n1)-c1ccccn1
Show InChI InChI=1S/C19H20N6O/c1-13(26)23-15-8-6-14(7-9-15)12-22-18-11-17(24-19(20-2)25-18)16-5-3-4-10-21-16/h3-11H,12H2,1-2H3,(H,23,26)(H2,20,22,24,25)
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n/an/an/an/a 2n/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Agonist activity at rat GPR39 expressed in HEK293 cells by IP1 assay


Citation and Details
More data for this
Ligand-Target Pair
G protein-coupled receptor 39-1b


(Rattus norvegicus)
BDBM50030774
PNG
(CHEMBL3342379)
Show SMILES CNc1nc(NCc2ccc(NC(C)=O)cc2F)cc(n1)-c1ccccn1
Show InChI InChI=1S/C19H19FN6O/c1-12(27)24-14-7-6-13(15(20)9-14)11-23-18-10-17(25-19(21-2)26-18)16-5-3-4-8-22-16/h3-10H,11H2,1-2H3,(H,24,27)(H2,21,23,25,26)
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n/an/an/an/a 0.600n/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Agonist activity at rat GPR39 expressed in HEK293 cells by IP1 assay


Citation and Details
More data for this
Ligand-Target Pair
G protein-coupled receptor 39-1b


(Rattus norvegicus)
BDBM50030788
PNG
(CHEMBL3342358)
Show SMILES CNc1nc(NCc2ccc(NS(C)(=O)=O)cc2Cl)cc(n1)-c1ccccn1
Show InChI InChI=1S/C18H19ClN6O2S/c1-20-18-23-16(15-5-3-4-8-21-15)10-17(24-18)22-11-12-6-7-13(9-14(12)19)25-28(2,26)27/h3-10,25H,11H2,1-2H3,(H2,20,22,23,24)
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PubMed
n/an/an/an/a 0.400n/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Agonist activity at rat GPR39 expressed in HEK293 cells by IP1 assay


Citation and Details
More data for this
Ligand-Target Pair