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Compile Data Set for Download or QSAR

Found 5 hits Enz. Inhib. hit(s) with Target = 'G-protein coupled receptor 35' and Ligand = 'BDBM50259858'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
G-protein coupled receptor 35


(Homo sapiens (Human))
BDBM50259858
PNG
(CHEMBL4077503)
Show SMILES OC(=O)c1cc2cc(Br)c(O)cc2oc1=O
Show InChI InChI=1S/C10H5BrO5/c11-6-2-4-1-5(9(13)14)10(15)16-8(4)3-7(6)12/h1-3,12H,(H,13,14)
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Article
PubMed
n/an/a 130n/an/an/an/an/an/a


TBA

Assay Description
Agonist activity at human GPR35 receptor expressed in HT-29 cells assessed as reduction in dynamic mass redistribution response in presence of GPR35 ...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01624
BindingDB Entry DOI: 10.7270/Q2T72N8P
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens (Human))
BDBM50259858
PNG
(CHEMBL4077503)
Show SMILES OC(=O)c1cc2cc(Br)c(O)cc2oc1=O
Show InChI InChI=1S/C10H5BrO5/c11-6-2-4-1-5(9(13)14)10(15)16-8(4)3-7(6)12/h1-3,12H,(H,13,14)
PDB

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UniProtKB/SwissProt

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UniChem

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Article
PubMed
n/an/a 3.76E+3n/an/an/an/an/an/a


TBA

Assay Description
Agonist activity at human GPR35 receptor expressed in HT-29 cells assessed as desensitization of zaprinast-induced DMR response preincubated for 1 hr...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01624
BindingDB Entry DOI: 10.7270/Q2T72N8P
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens (Human))
BDBM50259858
PNG
(CHEMBL4077503)
Show SMILES OC(=O)c1cc2cc(Br)c(O)cc2oc1=O
Show InChI InChI=1S/C10H5BrO5/c11-6-2-4-1-5(9(13)14)10(15)16-8(4)3-7(6)12/h1-3,12H,(H,13,14)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.76E+3n/an/an/an/an/an/a



Dalian Institute of Chemical Physics

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells assessed as induction of cell desensitization to 1 uM zaprinast preincubated for 1 hr followed by zapr...


J Med Chem 60: 362-372 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01431
BindingDB Entry DOI: 10.7270/Q2J67KC8
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens (Human))
BDBM50259858
PNG
(CHEMBL4077503)
Show SMILES OC(=O)c1cc2cc(Br)c(O)cc2oc1=O
Show InChI InChI=1S/C10H5BrO5/c11-6-2-4-1-5(9(13)14)10(15)16-8(4)3-7(6)12/h1-3,12H,(H,13,14)
PDB

KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

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Article
PubMed
n/an/an/an/a 4.34E+3n/an/an/an/a



Dalian Institute of Chemical Physics

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells by DMR assay


J Med Chem 60: 362-372 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01431
BindingDB Entry DOI: 10.7270/Q2J67KC8
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens (Human))
BDBM50259858
PNG
(CHEMBL4077503)
Show SMILES OC(=O)c1cc2cc(Br)c(O)cc2oc1=O
Show InChI InChI=1S/C10H5BrO5/c11-6-2-4-1-5(9(13)14)10(15)16-8(4)3-7(6)12/h1-3,12H,(H,13,14)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 4.34E+3n/an/an/an/a


TBA

Assay Description
Agonist activity at human GPR35 receptor expressed in HT-29 cells assessed as dynamic mass redistribution response by DMR assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01624
BindingDB Entry DOI: 10.7270/Q2T72N8P
More data for this
Ligand-Target Pair