InChIKey	AQIXAKUUQRKLND-UHFFFAOYSA-N
Compound Name	Cimetidine
Canonical SMILES	CNC(=NC#N)NCCSCc1[nH]cnc1C
Clinical Status	Data-mined Candidate
Targets (Human+Pathogen)	2
Pfam Stratification	Cross-Family
Avg pChEMBL	6.47
Source	BindingDB

DrugBank ID	DB00501
Drug Name	Cimetidine
CAS Number	51481-61-9
Groups	approved investigational
ATC Codes	A02BA51 A02BA01
Description	A histamine congener, it competitively inhibits histamine binding to histamine H2 receptors. Cimetidine has a range of pharmacological actions. It inhibits gastric acid secretion, as well as pepsin and gastrins output. It also blocks the activity of cytochrome P-450 which might explain proposals for...

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Categories: Acid Reducers Adjuvants Agents Causing Muscle Toxicity Alimentary Tract and Metabolism Amidines Anti-Ulcer Agents BSEP/ABCB11 Inhibitors Chemically-Induced Disorders Cytochrome P-450 CYP1A2 Inhibitors Cytochrome P-450 CYP1A2 Inhibitors (weak) Cytochrome P-450 CYP2C19 Inhibitors Cytochrome P-450 CYP2C19 inhibitors (strength unknown) Cytochrome P-450 CYP2C8 Inhibitors Cytochrome P-450 CYP2C8 Inhibitors (weak) Cytochrome P-450 CYP2C9 Inhibitors Cytochrome P-450 CYP2C9 Inhibitors (strength unknown) Cytochrome P-450 CYP2D6 Inhibitors Cytochrome P-450 CYP2D6 Inhibitors (weak) Cytochrome P-450 CYP2E1 Inhibitors Cytochrome P-450 CYP2E1 Inhibitors (strength unknown) Cytochrome P-450 CYP3A Inhibitors Cytochrome P-450 CYP3A4 Inhibitors Cytochrome P-450 CYP3A4 Inhibitors (weak) Cytochrome P-450 CYP3A5 Inhibitors Cytochrome P-450 CYP3A5 Inhibitors (weak) Cytochrome P-450 CYP3A7 Inhibitors Cytochrome P-450 CYP3A7 Inhibitors (moderate) Cytochrome P-450 Enzyme Inhibitors Drugs for Acid Related Disorders Drugs for Peptic Ulcer and Gastro-Oesophageal Reflux Disease (Gord) Drugs that are Mainly Renally Excreted Enzyme Inhibitors Gastric Acid Lowering Agents Gastrointestinal Agents Guanidines Histamine Agents Histamine Antagonists Histamine H2 Antagonists Imidazoles MATE 1 Inhibitors MATE 1 Substrates MATE 2 Inhibitors MATE 2 Substrates MATE inhibitors MATE substrates Neurotransmitter Agents OAT1/SLC22A6 Substrates OAT1/SLC22A6 inhibitors OAT3/SLC22A8 Inhibitors OAT3/SLC22A8 Substrates OCT1 inhibitors OCT1 substrates OCT2 Inhibitors OCT2 Substrates P-glycoprotein inducers P-glycoprotein substrates

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Cross-references: BindingDB: 50403559 ChEBI: 3699 CHEMBL30 ChemSpider: 2654 Drugs Product Database (DPD): 2165 Guide to Pharmacology: 1231 IUPHAR: 1231 C06952 D00295 PDB: SD9 PharmGKB: PA449001 PubChem:2756 PubChem:46505360 RxCUI: 2541 Therapeutic Targets Database: DAP000338 Wikipedia: Cimetidine ZINC: ZINC000018115268