BDBM50155758 IMBRICATOLIC ACID::Imbricatolic Acid

SMILES: [H][C@@]12CCC(=C)[C@H](CC[C@H](C)CCO)[C@@]1(C)CCC[C@]2(C)C(O)=O

InChI Key: InChIKey=NSRKLZRKJJQJLD-BEUFEYIVSA-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 = 50155758   

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
Protein-tyrosine phosphatase 1B (Homo sapiens (Human))	BDBM50155758 (IMBRICATOLIC ACID | Imbricatolic Acid) Show SMILES [H][C@@]12CCC(=C)[C@H](CC[C@H](C)CCO)[C@@]1(C)CCC[C@]2(C)C(O)=O |r| Show InChI InChI=1S/C20H34O3/c1-14(10-13-21)6-8-16-15(2)7-9-17-19(16,3)11-5-12-20(17,4)18(22)23/h14,16-17,21H,2,5-13H2,1,3-4H3,(H,22,23)/t14-,16-,17+,19+,20-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PubMed	n/a	n/a	8.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Lucknow Curated by ChEMBL					Assay Description Inhibition of human recombinant PTP-1B using IR5 insulin receptor residues as substrate after 30 mins by malachite green assay				Bioorg Med Chem Lett 26: 1988-92 (2016) BindingDB Entry DOI: 10.7270/Q2514147
					More data for this Ligand-Target Pair