BDBM9954 1,4-Androsten-3,17-dione::2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-3,6-diene-5,14-dione

SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CCC4=CC(=O)C=C[C@]34C

InChI Key: InChIKey=LUJVUUWNAPIQQI-UHFFFAOYSA-N

Data: 1 KI  1 IC50

PDB links: 5 PDB IDs match this monomer.

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Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 9954   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Aromatase (Human)	BDBM9954 (2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]he...) Show SMILES Show InChI	GoogleScholar	UniChem		43	-10.4	530	n/a	n/a	n/a	n/a	7.5	37
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