BindingDB logo
myBDB logout

BDBM50218097 ((3S,4R)-4-(4-chlorophenyl)-1-isopropylpyrrolidin-3-yl)(4-(2-methoxyphenyl)piperazin-1-yl)methanone::CHEMBL249348

SMILES: COc1ccccc1N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(Cl)cc1)C(C)C

InChI Key: InChIKey=QJDICFDTWUXVNF-FCHUYYIVSA-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 = 50218097   
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
Melanocortin receptor 4


(Homo sapiens (Human))		BDBM50218097
PNG
(((3S,4R)-4-(4-chlorophenyl)-1-isopropylpyrrolidin-...)
Show SMILES COc1ccccc1N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(Cl)cc1)C(C)C
Show InChI InChI=1S/C25H32ClN3O2/c1-18(2)29-16-21(19-8-10-20(26)11-9-19)22(17-29)25(30)28-14-12-27(13-15-28)23-6-4-5-7-24(23)31-3/h4-11,18,21-22H,12-17H2,1-3H3/t21-,22+/m0/s1
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
 520n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]NDP-MSH from human MC4R expressed in HEK293 cells

Bioorg Med Chem Lett 17: 5165-70 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.088
BindingDB Entry DOI: 10.7270/Q20R9P37
More data for this
Ligand-Target Pair