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BDBM50325607 (R)-21-(4-Hydroxybenzylcarbamoyl)-3,7,14,23-tetraoxo-24,24-diphenyl-2-oxa-6,15,17,22-tetraazatetracosan-16-iminium2,2,2-trifluoroacetate::CHEMBL1223995

SMILES: COC(=O)CCNC(=O)CCCCCCC(=O)NC(N)=NCCC[C@@H](NC(=O)C(c1ccccc1)c1ccccc1)C(=O)NCc1ccc(O)cc1

InChI Key: InChIKey=JMWDXLWLVWXNLL-JGCGQSQUSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50325607   
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
Neuropeptide Y receptor type 1


(Homo sapiens (Human))		BDBM50325607
PNG
((R)-21-(4-Hydroxybenzylcarbamoyl)-3,7,14,23-tetrao...)
Show SMILES COC(=O)CCNC(=O)CCCCCCC(=O)NC(N)=NCCC[C@@H](NC(=O)C(c1ccccc1)c1ccccc1)C(=O)NCc1ccc(O)cc1 |r,w:20.20|
Show InChI InChI=1S/C39H50N6O7/c1-52-35(49)24-26-41-33(47)18-10-2-3-11-19-34(48)45-39(40)42-25-12-17-32(37(50)43-27-28-20-22-31(46)23-21-28)44-38(51)36(29-13-6-4-7-14-29)30-15-8-5-9-16-30/h4-9,13-16,20-23,32,36,46H,2-3,10-12,17-19,24-27H2,1H3,(H,41,47)(H,43,50)(H,44,51)(H3,40,42,45,48)/t32-/m1/s1
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Article
PubMed
 260n/an/an/an/an/an/an/an/a



Universität Regensburg

Curated by ChEMBL


Assay Description
Displacement of [3H]UR-MK114 from NPY1 receptor in human SK-N-MC cells

Bioorg Med Chem 18: 6292-304 (2010)


Article DOI: 10.1016/j.bmc.2010.07.028
BindingDB Entry DOI: 10.7270/Q2416X87
More data for this
Ligand-Target Pair