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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Melanocortin receptor 4' and Ligand = 'BDBM160251'   
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 4


(Homo sapiens (Human))
BDBM160251
PNG
(US9040663, 97)
Show SMILES CC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H]1CCC(=O)NCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2cc(F)c(F)c(F)c2)NC(=O)[C@H](CCC(N)=O)NC1=O)C(O)=O
Show InChI InChI=1S/C49H67F3N16O11/c1-24(69)62-31(9-4-17-59-48(54)55)41(72)65-34-13-15-39(71)58-16-6-11-35(47(78)79)66-46(77)37(22-26-23-61-30-8-3-2-7-27(26)30)68-42(73)32(10-5-18-60-49(56)57)63-45(76)36(21-25-19-28(50)40(52)29(51)20-25)67-44(75)33(64-43(34)74)12-14-38(53)70/h2-3,7-8,19-20,23,31-37,61H,4-6,9-18,21-22H2,1H3,(H2,53,70)(H,58,71)(H,62,69)(H,63,76)(H,64,74)(H,65,72)(H,66,77)(H,67,75)(H,68,73)(H,78,79)(H4,54,55,59)(H4,56,57,60)/t31-,32-,33-,34-,35-,36+,37-/m0/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
0.75 -54.2n/an/an/an/an/a7.537



AstraZeneca AB

US Patent


Assay Description
A competitive inhibition binding assay was performed for exemplified peptides according to the invention using membrane homogenates prepared from HEK...


US Patent US9040663 (2015)


BindingDB Entry DOI: 10.7270/Q29885SK
More data for this
Ligand-Target Pair