BindingDB logo
myBDB logout

BDBM50186901 (R)-3-amino-N-(3-(2,4-dichlorophenyl)-1-(4-(3-((1-hydroxy-2-methylpropan-2-ylamino)methyl)pyridin-2-yl)piperazin-1-yl)-1-oxopropan-2-yl)propanamide::CHEMBL377186

SMILES: CC(C)(CO)NCc1cccnc1N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)CCN

InChI Key: InChIKey=COOGJODHRJNYQU-JOCHJYFZSA-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 = 50186901   
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))		BDBM50186901
PNG
((R)-3-amino-N-(3-(2,4-dichlorophenyl)-1-(4-(3-((1-...)
Show SMILES CC(C)(CO)NCc1cccnc1N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)CCN
Show InChI InChI=1S/C26H36Cl2N6O3/c1-26(2,17-35)31-16-19-4-3-9-30-24(19)33-10-12-34(13-11-33)25(37)22(32-23(36)7-8-29)14-18-5-6-20(27)15-21(18)28/h3-6,9,15,22,31,35H,7-8,10-14,16-17,29H2,1-2H3,(H,32,36)/t22-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
 480n/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 16: 3693-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.069
BindingDB Entry DOI: 10.7270/Q2NZ878P
More data for this
Ligand-Target Pair