BDBM124252 (1R,2S,3S,8R,9S,12S)-8-dodecyl-3,12-dimethyl-9-[(1E)-tetradec-1-en-1-yl]-4,11-dioxatricyclo[7.3.0.0,⁶]dodec-6-ene-5,10-dione (6)

SMILES: CCCCCCCCCCCC\C=C\[C@]12[C@H]([C@H](C)OC1=O)[C@@H]1[C@H](C)OC(=O)C1=C[C@H]2CCCCCCCCCCCC

InChI Key: InChIKey=XEWWOJCWAQSNEJ-XLDGRZTKSA-N

Data: 3 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 3 hits for monomerid = 124252   

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))	BDBM124252 ((1R,2S,3S,8R,9S,12S)-8-dodecyl-3,12-dimethyl-9-[(1...) Show SMILES CCCCCCCCCCCC\C=C\[C@]12[C@H]([C@H](C)OC1=O)[C@@H]1[C@H](C)OC(=O)C1=C[C@H]2CCCCCCCCCCCC |r,c:29| Show InChI InChI=1S/C38H64O4/c1-5-7-9-11-13-15-17-18-20-22-24-26-28-38-32(27-25-23-21-19-16-14-12-10-8-6-2)29-33-34(30(3)41-36(33)39)35(38)31(4)42-37(38)40/h26,28-32,34-35H,5-25,27H2,1-4H3/b28-26+/t30-,31-,32+,34+,35+,38-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.25E+3	n/a	n/a	n/a	n/a	n/a	n/a
Lanzhou University									Org Biomol Chem 12: 3441-5 (2014) Article DOI: 10.1039/c4ob00214h BindingDB Entry DOI: 10.7270/Q2JQ0ZPC
					More data for this Ligand-Target Pair
Dual specificity phosphatase Cdc25B (Homo sapiens (Human))	BDBM124252 ((1R,2S,3S,8R,9S,12S)-8-dodecyl-3,12-dimethyl-9-[(1...) Show SMILES CCCCCCCCCCCC\C=C\[C@]12[C@H]([C@H](C)OC1=O)[C@@H]1[C@H](C)OC(=O)C1=C[C@H]2CCCCCCCCCCCC |r,c:29| Show InChI InChI=1S/C38H64O4/c1-5-7-9-11-13-15-17-18-20-22-24-26-28-38-32(27-25-23-21-19-16-14-12-10-8-6-2)29-33-34(30(3)41-36(33)39)35(38)31(4)42-37(38)40/h26,28-32,34-35H,5-25,27H2,1-4H3/b28-26+/t30-,31-,32+,34+,35+,38-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.34E+3	n/a	n/a	n/a	n/a	n/a	n/a
Lanzhou University									Org Biomol Chem 12: 3441-5 (2014) Article DOI: 10.1039/c4ob00214h BindingDB Entry DOI: 10.7270/Q2JQ0ZPC
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 2 (Homo sapiens (Human))	BDBM124252 ((1R,2S,3S,8R,9S,12S)-8-dodecyl-3,12-dimethyl-9-[(1...) Show SMILES CCCCCCCCCCCC\C=C\[C@]12[C@H]([C@H](C)OC1=O)[C@@H]1[C@H](C)OC(=O)C1=C[C@H]2CCCCCCCCCCCC |r,c:29| Show InChI InChI=1S/C38H64O4/c1-5-7-9-11-13-15-17-18-20-22-24-26-28-38-32(27-25-23-21-19-16-14-12-10-8-6-2)29-33-34(30(3)41-36(33)39)35(38)31(4)42-37(38)40/h26,28-32,34-35H,5-25,27H2,1-4H3/b28-26+/t30-,31-,32+,34+,35+,38-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.32E+4	n/a	n/a	n/a	n/a	n/a	n/a
Lanzhou University									Org Biomol Chem 12: 3441-5 (2014) Article DOI: 10.1039/c4ob00214h BindingDB Entry DOI: 10.7270/Q2JQ0ZPC
					More data for this Ligand-Target Pair