DSigDB Home
Search Gene
Collections
Browse Gene Sets
Download
Help

Gene Set: D4 : TTD - Cimetidine

Collection D4 : TTD
Chemical Name Cimetidine ( From PubChem : CIMETIDINE )
FDA NPC WHO Indian Australia China Traditional
Herbal		 Clinical
Trail
ApprovedNotNotNotNotNotNotNot
Molecular
Weight		 Hydrogen Bond
Donor Count		 Hydrogen Bond
Acceptor Count		 cLogP Lipinski Rule
252.339 g/mol 3 6 1.37918 True
Structure
InChI InChI=1S/C10H16N6S/c1-8-9(16-7-15-8)5-17-4-3-13-10(12-2)14-6-11/h7H,3-5H2,1-2H3,(H,15,16)(H2,12,13,14)
InChIKey AQIXAKUUQRKLND-UHFFFAOYSA-N
Links

Gene (7 / 13)


⊖ Less
Source Type Unit Value Gene PMID Assay Other
TTDAntagonistHRH2Successful target
TTDDrug(s)HRH2Successful target
PubChem PotencyuM31.623CYP2C19-GI(Protien) :
PubChem NoneuMCYP2C19-GI(Protien) :
PubChem PotencyuM28.184POLK-GI(Protien) :
ChEMBLInhibition-CYP1A2
-Target : CHEMBL3356
ChEMBLAC50nM31622.800CYP2C19
-Target : CHEMBL3622
ChEMBLPotencynM31622.800CYP2C19
-Target : CHEMBL3622
ChEMBLInhibition-CYP2D6
-Target : CHEMBL289
ChEMBLInhibition-CYP3A4
-Target : CHEMBL340
ChEMBLInhibition-CYP3A4
-Target : CHEMBL340
ChEMBLInhibition-SLC22A2
-Target : CHEMBL1743122
ChEMBLInhibition-SLC22A2
-Target : CHEMBL1743122
Download gene sets gmt, text, Detailed text
Contact us
Tan Lab , Mail Stop 8117
12801 East 17th Avenue
Division of Medical Oncology , Department of Medicine
University of Colorado School of Medicine
Aurora, CO 80045, USA

* Best viewed in the latest version of Chrome (42+), Safari (8+), IE (11+) or Firefox (35+).