BindingDB logo
myBDB logout

BDBM50190887 2-[6-(3-cyano-phenyl)-1'-cyclopentyl-3,4-dihydro-spiro[isoquinoline-1,4'-piperidin]-2-yl]-N-(3,5-dichloro-phenyl)-acetamide::CHEMBL211978

SMILES: Clc1cc(Cl)cc(NC(=O)CN2CCc3cc(ccc3C22CCN(CC2)C2CCCC2)-c2cccc(c2)C#N)c1

InChI Key: InChIKey=IFVDAKOERJNKCP-UHFFFAOYSA-N

Data: 1 KI

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 = 50190887   
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
Melanin-concentrating hormone receptor


(Homo sapiens (Human))
BDBM50190887
PNG
(2-[6-(3-cyano-phenyl)-1'-cyclopentyl-3,4-dihydro-s...)
Show SMILES Clc1cc(Cl)cc(NC(=O)CN2CCc3cc(ccc3C22CCN(CC2)C2CCCC2)-c2cccc(c2)C#N)c1
Show InChI InChI=1S/C33H34Cl2N4O/c34-27-18-28(35)20-29(19-27)37-32(40)22-39-13-10-26-17-25(24-5-3-4-23(16-24)21-36)8-9-31(26)33(39)11-14-38(15-12-33)30-6-1-2-7-30/h3-5,8-9,16-20,30H,1-2,6-7,10-15,22H2,(H,37,40)
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
16n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity to human MCHR1


Bioorg Med Chem Lett 16: 4917-21 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.055
BindingDB Entry DOI: 10.7270/Q2WW7H83
More data for this
Ligand-Target Pair