[(1S,3R,7S,8S,8aR)-8-[(3R,5R)-3,5-dihydroxy-7-(hydroxyamino)-7-oxoheptyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] (2S)-2-methylbutanoate

InChIKey	`UZLJJCAWULBGEN-BXMDZJJMSA-N`
Compound Name	[(1S,3R,7S,8S,8aR)-8-[(3R,5R)-3,5-dihydroxy-7-(hydroxyamino)-7-oxoheptyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] (2S)-2-methylbutanoate
Canonical SMILES	`CC[C@H](C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H](O)C[C@@H](O)CC(=O)NO)[C@H]21`
Clinical Status	Data-mined Candidate
Targets (Human+Pathogen)	4
Pfam Stratification	Cross-Family
Avg pChEMBL	7.15
Source	ChEMBL;BindingDB

2D Structure

Activity Profile

Target	Gene	Organism	Category	Pfam	pChEMBL	Type	Source
P04035	HMGCR	Homo sapiens	Human	PF00368 PF12349	7.8	IC50	ChEMBL;BindingDB
Q9UBN7	HDAC6	Homo sapiens	Human	PF00850 PF02148	7.3	IC50	ChEMBL;BindingDB
Q13547	HDAC1	Homo sapiens	Human	PF00850	7.2	IC50	ChEMBL;BindingDB
Q92769	HDAC2	Homo sapiens	Human	PF00850	6.3	IC50	ChEMBL;BindingDB