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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Motilin receptor' and Ligand = 'BDBM50344951'   
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
Motilin receptor


(Oryctolagus cuniculus)		BDBM50344951
PNG
(2-((2R,3S,4R,5R,6S,7R,9R,10R,11S,12S,13R)-2-ethyl-...)
Show SMILES CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@](C)(C[C@H](C)O2)OC)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C(C)C)[C@](C)(O)C[C@@H](C)[C@H](OCC(=O)N(C)C)[C@H](C)[C@@H](O)[C@]1(C)O |r|
Show InChI InChI=1S/C43H80N2O13/c1-17-31-43(12,51)37(48)27(7)35(53-22-32(46)44(13)14)24(4)19-42(11,50)38(58-40-34(47)30(18-25(5)55-40)45(15)23(2)3)28(8)36(29(9)39(49)56-31)57-33-21-41(10,52-16)20-26(6)54-33/h23-31,33-38,40,47-48,50-51H,17-22H2,1-16H3/t24-,25-,26+,27+,28+,29-,30+,31-,33+,34-,35+,36+,37-,38-,40+,41+,42-,43-/m1/s1
Reactome pathway
KEGG

UniProtKB/TrEMBL

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/an/an/a 190n/an/an/an/a



Kosan Biosciences, Inc.

Curated by ChEMBL


Assay Description
Agonist activity at motilin receptor in rabbit smooth muscle assessed as maximal possible tissue contraction

Bioorg Med Chem Lett 21: 3712-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.04.078
BindingDB Entry DOI: 10.7270/Q21J9B3B
More data for this
Ligand-Target Pair