BindingDB logo
myBDB logout

BDBM50367848 SQ-9538::TESTOLACTONE::Teslac

SMILES: C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1CCC(=O)O2

InChI Key: InChIKey=BPEWUONYVDABNZ-DZBHQSCQSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50367848   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Aromatase (CYP19)


(Homo sapiens (human))
BDBM50367848
PNG
(SQ-9538 | TESTOLACTONE | Teslac)
Show SMILES C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1CCC(=O)O2
Show InChI InChI=1S/C19H24O3/c1-18-9-7-13(20)11-12(18)3-4-14-15(18)8-10-19(2)16(14)5-6-17(21)22-19/h7,9,11,14-16H,3-6,8,10H2,1-2H3/t14-,15+,16+,18+,19+/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

DrugBank
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
3.50E+4n/an/an/an/an/an/an/an/a



Janssen Research Foundation

Curated by ChEMBL


Assay Description
In vitro inhibition of Cytochrome P450 19A1


J Med Chem 32: 2231-9 (1989)


Article DOI: 10.1021/jm00130a001
BindingDB Entry DOI: 10.7270/Q2Q52Q60
More data for this
Ligand-Target Pair