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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Melanocortin receptor 5' and Ligand = 'BDBM50100753'   
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 5


(Mus musculus (Mouse))		BDBM50100753
PNG
(Ac-Ser-Tyr-Ser-Nle-Glu-His-DPhe-Arg-Trp-NH2 | CHEM...)
Show SMILES CCCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(C)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O
Show InChI InChI=1S/C60H80N16O15/c1-3-4-14-41(70-59(91)49(31-78)76-56(88)46(25-35-17-19-38(80)20-18-35)74-58(90)48(30-77)68-33(2)79)52(84)71-43(21-22-50(81)82)54(86)75-47(27-37-29-64-32-67-37)57(89)73-45(24-34-11-6-5-7-12-34)55(87)69-42(16-10-23-65-60(62)63)53(85)72-44(51(61)83)26-36-28-66-40-15-9-8-13-39(36)40/h5-9,11-13,15,17-20,28-29,32,41-49,66,77-78,80H,3-4,10,14,16,21-27,30-31H2,1-2H3,(H2,61,83)(H,64,67)(H,68,79)(H,69,87)(H,70,91)(H,71,84)(H,72,85)(H,73,89)(H,74,90)(H,75,86)(H,76,88)(H,81,82)(H4,62,63,65)/t41-,42-,43-,44-,45+,46-,47-,48-,49-/m0/s1
UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
PubMed
n/an/an/an/a 0.530n/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
Functional activity at the mouse melanocortin 5 receptor

J Med Chem 44: 2247-52 (2001)


BindingDB Entry DOI: 10.7270/Q2GB24S4
More data for this
Ligand-Target Pair