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BDBM50199367 (9R,12R,15S)-9-(4-hydroxy-benzyl)-12-hydroxymethyl-15-propyl-6,7,8,9,11,12,14,15,17,18-decahydro-5-oxa-8,11,14,17-tetraaza-benzocyclooctadecene-10,13,16-trione::CHEMBL214543

SMILES: CCC[C@@H]1NC(=O)[C@@H](CO)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2\C=C\CNC1=O

InChI Key: InChIKey=AQYIAAXJNZVUPE-DDAQEBKQSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50199367   
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))
BDBM50199367
PNG
((9R,12R,15S)-9-(4-hydroxy-benzyl)-12-hydroxymethyl...)
Show SMILES CCC[C@@H]1NC(=O)[C@@H](CO)NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2\C=C\CNC1=O
Show InChI InChI=1S/C28H36N4O6/c1-2-6-22-26(35)30-14-5-8-20-7-3-4-9-25(20)38-16-15-29-23(17-19-10-12-21(34)13-11-19)27(36)32-24(18-33)28(37)31-22/h3-5,7-13,22-24,29,33-34H,2,6,14-18H2,1H3,(H,30,35)(H,31,37)(H,32,36)/b8-5+/t22-,23+,24+/m0/s1
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Similars

Article
PubMed
>1.00E+4n/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