Drug Information

Drug General Information
Drug ID
D01AUI
Former ID
DNC001322
Drug Name
SF303
Drug Type
Small molecular drug
Indication Discovery agent Investigative [1]
Structure
Download
2D MOL

3D MOL
Formula
C20H27N5O5
Canonical SMILES
CCCCCN=C(N)NNC=C1C=NC2=C1C=C(C=C2)OC.C(=CC(=O)O)C(=O)O
InChI
1S/C16H23N5O.C4H4O4/c1-3-4-5-8-18-16(17)21-20-11-12-10-19-15-7-6-13(22-2)9-14(12)15;5-3(6)1-2-4(7)8/h6-7,9-11,20H,3-5,8H2,1-2H3,(H3,17,18,21);1-2H,(H,5,6)(H,7,8)/b12-11+;2-1-
InChIKey
KIJRKSHEIAFGBH-KSNCNXGASA-N
CAS Number
CAS 145158-71-0
PubChem Compound ID
6918369
PubChem Substance ID
12015123, 14806791, 16655725, 17396897, 26612835, 26680669, 26748994, 26748995, 32963935, 37101836, 43529745, 46386624, 49681580, 49831519, 50462005, 57371904, 81043815, 91011723, 92124835, 92308420, 114787862, 118843555, 124637881, 124659006, 124799787, 125268658, 126591275, 126655823, 134340523, 135692402, 144076418, 163322681, 164234023, 165232158, 172080392, 179212682, 179295972, 184021429, 196112020, 211536225, 223662763, 226414855, 227292092, 241377086, 252158215, 252401563
ChEBI ID
ChEBI:51043
SuperDrug ATC ID
A03AE02
SuperDrug CAS ID
cas=145158710
Target and Pathway
Target(s) Coagulation factor Xa Target Info Inhibitor [1]
KEGG Pathway Complement and coagulation cascades
PANTHER Pathway Blood coagulation
Pathway Interaction Database Beta2 integrin cell surface interactions
PathWhiz Pathway Coagulation
Reactome Extrinsic Pathway of Fibrin Clot Formation
Intrinsic Pathway of Fibrin Clot Formation
Common Pathway of Fibrin Clot Formation
Gamma-carboxylation of protein precursors
Transport of gamma-carboxylated protein precursors from the endoplasmic reticulum to the Golgi apparatus
Removal of aminoterminal propeptides from gamma-carboxylated proteins
WikiPathways Complement and Coagulation Cascades
Human Complement System
PTM: gamma carboxylation, hypusine formation and arylsulfatase activation
Blood Clotting Cascade
Formation of Fibrin Clot (Clotting Cascade)
References
REF 1The design and synthesis of noncovalent factor Xa inhibitors. Curr Top Med Chem. 2001 Jun;1(2):137-49.

If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.