BindingDB logo
myBDB logout

BDBM50413231 CHEMBL458353

SMILES: COc1ccc(c(C)c1)-n1ccc2c(cc(C)nc12)-n1ccc(n1)-c1nccs1

InChI Key: InChIKey=WEIVYTPGBWNIDY-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50413231   
Target/Host
(Institution)
LigandTarget/Host
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
Corticotropin releasing factor receptor 1


(Homo sapiens (Human))
BDBM50413231
PNG
(CHEMBL458353)
Show SMILES COc1ccc(c(C)c1)-n1ccc2c(cc(C)nc12)-n1ccc(n1)-c1nccs1
Show InChI InChI=1S/C22H19N5OS/c1-14-12-16(28-3)4-5-19(14)26-9-6-17-20(13-15(2)24-21(17)26)27-10-7-18(25-27)22-23-8-11-29-22/h4-13H,1-3H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 427n/an/an/an/an/an/a



GlaxoSmithKline Medicines Research Centre

Curated by ChEMBL


Assay Description
Displacement of [125I]sauvagine from human recombinant CRF1 receptor expressed in CHO cells by SPA


J Med Chem 51: 7273-86 (2009)


Article DOI: 10.1021/jm800743q
BindingDB Entry DOI: 10.7270/Q2TT4S62
More data for this
Ligand-Target Pair