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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Melanocyte-stimulating hormone receptor' and Ligand = 'BDBM50141033'   
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
Melanocyte-stimulating hormone receptor


(Homo sapiens (Human))		BDBM50141033
PNG
(1N-(1-carbamoyl-2-hydroxypropyl)-15-[3-amino(imino...)
Show SMILES C[C@@H](O)[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@H](N)Cc2ccccc2)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N[C@@H](Cc2cccc3ccccc23)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)N1)C(N)=O
Show InChI InChI=1S/C55H67N15O9S2/c1-30(71)46(47(57)72)70-54(79)45-28-81-80-27-44(68-48(73)38(56)21-31-11-3-2-4-12-31)53(78)67-43(24-35-26-60-29-63-35)52(77)66-41(22-33-15-9-14-32-13-5-6-16-36(32)33)50(75)64-40(19-10-20-61-55(58)59)49(74)65-42(51(76)69-45)23-34-25-62-39-18-8-7-17-37(34)39/h2-9,11-18,25-26,29-30,38,40-46,62,71H,10,19-24,27-28,56H2,1H3,(H2,57,72)(H,60,63)(H,64,75)(H,65,74)(H,66,77)(H,67,78)(H,68,73)(H,69,76)(H,70,79)(H4,58,59,61)/t30-,38-,40+,41+,42-,43+,44+,45+,46+/m1/s1
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Similars
Article
PubMed
n/an/an/an/a 5.00E+3n/an/an/an/a



University of Arizona

Curated by ChEMBL


Assay Description
Effective concentration required for maximum agonist response at melanocortin 1 receptor from frog skin.

J Med Chem 47: 1514-26 (2004)


Article DOI: 10.1021/jm030452x
BindingDB Entry DOI: 10.7270/Q2XP75PK
More data for this
Ligand-Target Pair