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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Melanocortin receptor 3' and Ligand = 'BDBM50001477'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Melanocortin receptor 3


(Homo sapiens (Human))
BDBM50001477
PNG
(CHEMBL2372588)
Show SMILES [H][C@@]12Cc3ccccc3N1C(=O)[C@@H](CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c3ccccc13)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccc3ccccc3c1)NC2=O)C(N)=O)NC(=O)[C@@H](CCCC)NC(C)=O |r|
Show InChI InChI=1S/C57H71N13O9/c1-3-4-18-42(64-33(2)71)51(74)69-46-31-49(72)61-25-12-11-20-41(50(58)73)65-54(77)45(29-38-32-63-40-19-9-8-17-39(38)40)67-52(75)43(21-13-26-62-57(59)60)66-53(76)44(28-34-23-24-35-14-5-6-15-36(35)27-34)68-55(78)48-30-37-16-7-10-22-47(37)70(48)56(46)79/h5-10,14-17,19,22-24,27,32,41-46,48,63H,3-4,11-13,18,20-21,25-26,28-31H2,1-2H3,(H2,58,73)(H,61,72)(H,64,71)(H,65,77)(H,66,76)(H,67,75)(H,68,78)(H,69,74)(H4,59,60,62)/t41-,42+,43+,44-,45-,46+,48-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 290n/an/an/an/an/an/a



University of Arizona

Curated by ChEMBL


Assay Description
Binding affinity for human Melanocortin-3 receptor


J Med Chem 45: 5287-94 (2002)


BindingDB Entry DOI: 10.7270/Q20G3KW8
More data for this
Ligand-Target Pair