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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'G-protein coupled receptor 35' and Ligand = 'BDBM50323334'   
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))
BDBM50323334
PNG
(CHEMBL4159575)
Show SMILES COc1ccc(C(=O)Nc2cc(Br)ccc2-c2nnn[nH]2)c(F)c1
Show InChI InChI=1S/C15H11BrFN5O2/c1-24-9-3-5-10(12(17)7-9)15(23)18-13-6-8(16)2-4-11(13)14-19-21-22-20-14/h2-7H,1H3,(H,18,23)(H,19,20,21,22)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 14n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Desensitization of GPR35 in human HT-29 cells assessed as inhibition of zaprinast-induced dynamic mass redistribution pretreated for 1 hr followed by...


ACS Med Chem Lett 9: 422-427 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00510
BindingDB Entry DOI: 10.7270/Q2GB26K8
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens (Human))
BDBM50323334
PNG
(CHEMBL4159575)
Show SMILES COc1ccc(C(=O)Nc2cc(Br)ccc2-c2nnn[nH]2)c(F)c1
Show InChI InChI=1S/C15H11BrFN5O2/c1-24-9-3-5-10(12(17)7-9)15(23)18-13-6-8(16)2-4-11(13)14-19-21-22-20-14/h2-7H,1H3,(H,18,23)(H,19,20,21,22)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 41n/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells by dynamic mass redistribution assay


ACS Med Chem Lett 9: 422-427 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00510
BindingDB Entry DOI: 10.7270/Q2GB26K8
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens (Human))
BDBM50323334
PNG
(CHEMBL4159575)
Show SMILES COc1ccc(C(=O)Nc2cc(Br)ccc2-c2nnn[nH]2)c(F)c1
Show InChI InChI=1S/C15H11BrFN5O2/c1-24-9-3-5-10(12(17)7-9)15(23)18-13-6-8(16)2-4-11(13)14-19-21-22-20-14/h2-7H,1H3,(H,18,23)(H,19,20,21,22)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 42n/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Agonist activity at GPR35 in human HT-29 cells by dynamic mass redistribution assay


ACS Med Chem Lett 9: 422-427 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00510
BindingDB Entry DOI: 10.7270/Q2GB26K8
More data for this
Ligand-Target Pair