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1 similar compounds to monomer 50003569

Wt: 608.6
BDBM50003568

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50003568   
Target
(Institution)
LigandTarget
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
G-protein coupled bile acid receptor 1


(Mus musculus)
BDBM50003568
PNG
(CHEMBL3234583)
Show SMILES OC(=O)Cc1ccc(OC2CCN(CC2)c2cc(nc(n2)C(F)(F)F)N2CC[C@H]2C(=O)NCCc2ccc(cc2)C#N)cc1
Show InChI InChI=1S/C31H31F3N6O4/c32-31(33,34)30-37-26(39-14-10-24(11-15-39)44-23-7-5-21(6-8-23)17-28(41)42)18-27(38-30)40-16-12-25(40)29(43)36-13-9-20-1-3-22(19-35)4-2-20/h1-8,18,24-25H,9-17H2,(H,36,43)(H,41,42)/t25-/m0/s1
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KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/an/an/a 2n/an/an/an/a



Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at mouse TGR5 expressed in Jurkat cells assessed as intracellular cAMP level after 1 hr by HTRF assay


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


(Homo sapiens (human))
BDBM50003568
PNG
(CHEMBL3234583)
Show SMILES OC(=O)Cc1ccc(OC2CCN(CC2)c2cc(nc(n2)C(F)(F)F)N2CC[C@H]2C(=O)NCCc2ccc(cc2)C#N)cc1
Show InChI InChI=1S/C31H31F3N6O4/c32-31(33,34)30-37-26(39-14-10-24(11-15-39)44-23-7-5-21(6-8-23)17-28(41)42)18-27(38-30)40-16-12-25(40)29(43)36-13-9-20-1-3-22(19-35)4-2-20/h1-8,18,24-25H,9-17H2,(H,36,43)(H,41,42)/t25-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/an/an/a 30n/an/an/an/a



Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human TGR5 expressed in Jurkat cells assessed as intracellular cAMP level after 1 hr by HTRF assay


Citation and Details
More data for this
Ligand-Target Pair