AKJHMTWEGVYYSE-FXILSDISSA-N

Molecule Details

InChIKey	`AKJHMTWEGVYYSE-FXILSDISSA-N`
Canonical SMILES	`CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C(=O)Nc2ccc(O)cc2)C(C)(C)CCC1`
Clinical Status	Data-mined Candidate
Targets (Human+Pathogen)	2
Pfam Stratification	Cross-Family
Avg pChEMBL	6.9
Source	ChEMBL;BindingDB

2D Structure

Activity Profile

DrugBank Annotations

DrugBank ID	DB05076
Drug Name	Fenretinide
CAS Number	65646-68-6
Groups	investigational
ATC Codes	nan
Description	A synthetic retinoid that is used orally as a chemopreventive against prostate cancer and in women at risk of developing contralateral breast cancer. It is also effective as an antineoplastic agent.

Categories: Alkenes Anticarcinogenic Agents Antineoplastic Agents Biological Factors Carotenoids Compounds used in a research, industrial, or household setting Cyclohexanes Cyclohexenes Cycloparaffins Hydrocarbons, Acyclic Pigments, Biological Polyenes Protective Agents Retinoids Terpenes

Cross-references: BindingDB: 50092055 ChEBI: 42588 CHEMBL7301 ChemSpider: 4450416 D04162 PDB: FEN PubChem:5288209 PubChem:175426938 Wikipedia: Fenretinide ZINC: ZINC000003871023

Target Activities (2)

Target	Gene	Organism	Category	Pfam	pChEMBL	Type	Source
O15121	DEGS1	Homo sapiens	Human	PF00487 PF08557	7.0	IC50	ChEMBL;BindingDB
P02753	RBP4	Homo sapiens	Human	PF00061	6.8	Kd	ChEMBL

DrugBank Target Actions (1)

Target	Gene	Target Name	Action	Type
P02753	RBP4	Retinol-binding protein 4	binder	carriers