Drug Information

Drug General Information
Drug ID
D04TXE
Former ID
DNC004607
Drug Name
PD-157672
Drug Type
Small molecular drug
Indication Discovery agent Investigative [539348]
Formula
C32H47N5O5
InChI
InChI=1S/C32H47N5O5/c1-31(2,3)42-30(41)36-26(22-24-16-10-8-11-17-24)27(38)37-32(4,23-25-18-12-9-13-19-25)28(39)34-20-14-6-5-7-15-21-35-29(33)40/h8-13,16-19,26H,5-7,14-15,20-23H2,1-4H3,(H,34,39)(H,36,41)(H,37,38)(H3,33,35,40)/t26-,32+/m0/s1
InChIKey
BYVRLIUFCGUMSP-XYFQYJLHSA-N
PubChem Compound ID
5311350
PubChem Substance ID
7980262, 11056453, 14862355, 39341037, 50777556, 57359446, 103226204, 103947770, 114155889, 135650800
Target and Pathway
Target(s) Nigral tachykinin NK(3) receptor Target Info Inhibitor [551267]
KEGG Pathway Calcium signaling pathway
Neuroactive ligand-receptor interaction
Reactome G alpha (q) signalling events
WikiPathways Gastrin-CREB signalling pathway via PKC and MAPK
Peptide GPCRs
GPCR ligand binding
GPCR downstream signaling
References
Ref 539348(http://www.guidetopharmacology.org/) Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 2125).
Ref 551267The rational development of small molecule tachykinin NK3 receptor selective antagonists - the utilisation of a dipeptide chemical library in drug design, Bioorg. Med. Chem. Lett. 4(14):1679-1684 (1994).

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