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BDBM50235781 1-((2R,3R)-2-(1-(2-((S)-1-amino-2-methylpropyl)-4-methylphenyl)piperazine-4-carbonyl)-3-(4-fluorophenyl)pyrrolidin-1-yl)ethanone::CHEMBL256540

SMILES: CC(C)[C@H](N)c1cc(C)ccc1N1CCN(CC1)C(=O)[C@H]1[C@H](CCN1C(C)=O)c1ccc(F)cc1

InChI Key: InChIKey=BNWZLYBYTDGSQA-DURWQBQJSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50235781   
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))
BDBM50235781
PNG
(1-((2R,3R)-2-(1-(2-((S)-1-amino-2-methylpropyl)-4-...)
Show SMILES CC(C)[C@H](N)c1cc(C)ccc1N1CCN(CC1)C(=O)[C@H]1[C@H](CCN1C(C)=O)c1ccc(F)cc1
Show InChI InChI=1S/C28H37FN4O2/c1-18(2)26(30)24-17-19(3)5-10-25(24)31-13-15-32(16-14-31)28(35)27-23(11-12-33(27)20(4)34)21-6-8-22(29)9-7-21/h5-10,17-18,23,26-27H,11-16,30H2,1-4H3/t23-,26+,27-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
330n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125]NDPMSH from human MC4 receptor expressed in HEK293 cells


Bioorg Med Chem Lett 18: 1931-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.01.125
BindingDB Entry DOI: 10.7270/Q2WD409C
More data for this
Ligand-Target Pair