BDBM50213210 FUTOENONE

SMILES: [H][C@]12C[C@@]3(C=C(OC)C(=O)C=C3O1)[C@H](C)[C@H](C2)c1ccc2OCOc2c1

InChI Key: InChIKey=SXHVHWXETMBKPP-KXXATPMCSA-N

Data: 1 IC50

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 = 50213210   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Stromelysin-1 (Homo sapiens (Human))	BDBM50213210 (FUTOENONE) Show SMILES [H][C@]12C[C@@]3(C=C(OC)C(=O)C=C3O1)[C@H](C)[C@H](C2)c1ccc2OCOc2c1 |c:10,t:4| Show InChI InChI=1S/C20H20O5/c1-11-14(12-3-4-16-17(5-12)24-10-23-16)6-13-8-20(11)9-18(22-2)15(21)7-19(20)25-13/h3-5,7,9,11,13-14H,6,8,10H2,1-2H3/t11-,13+,14+,20-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article	n/a	n/a	<1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human recombinant matrix metalloprotease-3 (Stromelysin) at 10 uM				Bioorg Med Chem Lett 5: 1637-1642 (1995) Article DOI: 10.1016/0960-894X(95)00282-X BindingDB Entry DOI: 10.7270/Q2J38SJB
					More data for this Ligand-Target Pair