TTD | Drug: D08WBJ

Drug General Information
Drug ID	D08WBJ
Former ID	DCL000144
Drug Name	KOS-2187
Drug Type	Small molecular drug
Indication	Gastrointestinal disorders; Gastroesophageal reflux disease [ICD9: 530, 530-558; ICD10:K20-K64, K21]		Phase 1	[536527]
Company	Kosan Biosci.
Structure		Download 2D MOL 3D MOL
Formula	C43H73NO13
Canonical SMILES	CC1CC(C(C(O1)OC2C(C(C(C(=O)OC(C(C(C(C(C(CC2(C)O)C)O)C)O<br />)(C)O)C3=CC=CC=C3)C)OC4CC(C(C(O4)C)O)(C)OC)C)O)N(C)C(C)<br />C
InChI	1S/C43H73NO13/c1-22(2)44(12)30-19-24(4)53-40(33(30)46)57-37-26(6)34(55-31-21-42(10,52-13)36(48)28(8)54-31)27(7)39(49)56-38(29-17-15-14-16-18-29)43(11,51)35(47)25(5)32(45)23(3)20-41(37,9)50/h14-18,22-28,30-38,40,45-48,50-51H,19-21H2,1-13H3/t23-,24?,25+,26+,27-,28?,30?,31?,32+,33?,34+,35-,36?,37-,38-,40?,41-,42?,43+/m1/s1
InChIKey	BCKWPVFDVOGCTM-AFGVNUEFSA-N
PubChem Compound ID	56603679
PubChem Substance ID	134338824, 142842007, 143217036, 248437413
Target and Pathway
Target(s)	Motilin receptor	Target Info	Agonist	[551564]
KEGG Pathway	Neuroactive ligand-receptor interaction
Reactome	Peptide ligand-binding receptors
Reactome	G alpha (q) signalling events
WikiPathways	GPCRs, Class A Rhodopsin-like
	Gastrin-CREB signalling pathway via PKC and MAPK
	GPCR ligand binding
	GPCR downstream signaling
References
Ref 536527	Emerging drugs for postoperative ileus. Expert Opin Emerg Drugs. 2007 Nov;12(4):619-26.
Ref 551564	Kosan Announces Selection of KOS-2187 As Motilide Clinical Candidate at World Congress of Gastroenterology Meeting. Kosan. 2006.

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Drug Information