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BDBM50199385 (9R,12R,15S)-9-(4-hydroxy-benzyl)-12-isopropyl-15-propyl-7,8,9,10,11,12,14,15,17,18,19,20-dodecahydro-6H-5-oxa-8,11,14,17-tetraaza-benzocyclooctadecene-13,16-dione::CHEMBL214685

SMILES: CCC[C@@H]1NC(=O)[C@H](NC[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2CCCNC1=O)C(C)C

InChI Key: InChIKey=OWUJFYWLMKKBMY-MAARLIENSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50199385   
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
Motilin receptor


(Homo sapiens (Human))		BDBM50199385
PNG
((9R,12R,15S)-9-(4-hydroxy-benzyl)-12-isopropyl-15-...)
Show SMILES CCC[C@@H]1NC(=O)[C@H](NC[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2CCCNC1=O)C(C)C
Show InChI InChI=1S/C30H44N4O4/c1-4-8-26-29(36)32-16-7-10-23-9-5-6-11-27(23)38-18-17-31-24(19-22-12-14-25(35)15-13-22)20-33-28(21(2)3)30(37)34-26/h5-6,9,11-15,21,24,26,28,31,33,35H,4,7-8,10,16-20H2,1-3H3,(H,32,36)(H,34,37)/t24-,26+,28-/m1/s1
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Similars
Article
PubMed
 3.24E+3n/an/an/an/an/an/an/an/a



Tranzyme Pharma Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]motilin from human MOTR

J Med Chem 49: 7190-7 (2006)


Article DOI: 10.1021/jm0606600
BindingDB Entry DOI: 10.7270/Q2251JZH
More data for this
Ligand-Target Pair