BDBM50388819 CHEMBL2062713

SMILES: CCCCCCCCCCCCCCCC(NCc1ccccc1OC)=C1C(=O)OC(CO)C1=O

InChI Key: InChIKey=YKDAGORLJXJUPV-UHFFFAOYSA-N

Data: 7 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 7 hits for monomerid = 50388819   

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
Dual Specificity Protein Phosphatase 1 (Homo sapiens (Human))	BDBM50388819 (CHEMBL2062713) Show SMILES CCCCCCCCCCCCCCCC(NCc1ccccc1OC)=C1C(=O)OC(CO)C1=O |w:15.15| Show InChI InChI=1S/C29H45NO5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-24(27-28(32)26(22-31)35-29(27)33)30-21-23-18-16-17-20-25(23)34-2/h16-18,20,26,30-31H,3-15,19,21-22H2,1-2H3	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of MKP1				ACS Med Chem Lett 3: 294-298 (2012) Article DOI: 10.1021/ml2002778 BindingDB Entry DOI: 10.7270/Q2ZW1N0H
					More data for this Ligand-Target Pair
Dual specificity protein phosphatase 6 (Homo sapiens (Human))	BDBM50388819 (CHEMBL2062713) Show SMILES CCCCCCCCCCCCCCCC(NCc1ccccc1OC)=C1C(=O)OC(CO)C1=O |w:15.15| Show InChI InChI=1S/C29H45NO5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-24(27-28(32)26(22-31)35-29(27)33)30-21-23-18-16-17-20-25(23)34-2/h16-18,20,26,30-31H,3-15,19,21-22H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of MKP3				ACS Med Chem Lett 3: 294-298 (2012) Article DOI: 10.1021/ml2002778 BindingDB Entry DOI: 10.7270/Q2ZW1N0H
					More data for this Ligand-Target Pair
phosphatase Cdc25 (Homo sapiens (Human))	BDBM50388819 (CHEMBL2062713) Show SMILES CCCCCCCCCCCCCCCC(NCc1ccccc1OC)=C1C(=O)OC(CO)C1=O |w:15.15| Show InChI InChI=1S/C29H45NO5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-24(27-28(32)26(22-31)35-29(27)33)30-21-23-18-16-17-20-25(23)34-2/h16-18,20,26,30-31H,3-15,19,21-22H2,1-2H3	MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of CDC25A				ACS Med Chem Lett 3: 294-298 (2012) Article DOI: 10.1021/ml2002778 BindingDB Entry DOI: 10.7270/Q2ZW1N0H
					More data for this Ligand-Target Pair
Protein-tyrosine phosphatase 1B (Homo sapiens (Human))	BDBM50388819 (CHEMBL2062713) Show SMILES CCCCCCCCCCCCCCCC(NCc1ccccc1OC)=C1C(=O)OC(CO)C1=O |w:15.15| Show InChI InChI=1S/C29H45NO5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-24(27-28(32)26(22-31)35-29(27)33)30-21-23-18-16-17-20-25(23)34-2/h16-18,20,26,30-31H,3-15,19,21-22H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of PTP1B				ACS Med Chem Lett 3: 294-298 (2012) Article DOI: 10.1021/ml2002778 BindingDB Entry DOI: 10.7270/Q2ZW1N0H
					More data for this Ligand-Target Pair
Cdc25C (Homo sapiens (Human))	BDBM50388819 (CHEMBL2062713) Show SMILES CCCCCCCCCCCCCCCC(NCc1ccccc1OC)=C1C(=O)OC(CO)C1=O |w:15.15| Show InChI InChI=1S/C29H45NO5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-24(27-28(32)26(22-31)35-29(27)33)30-21-23-18-16-17-20-25(23)34-2/h16-18,20,26,30-31H,3-15,19,21-22H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of CDC25C				ACS Med Chem Lett 3: 294-298 (2012) Article DOI: 10.1021/ml2002778 BindingDB Entry DOI: 10.7270/Q2ZW1N0H
					More data for this Ligand-Target Pair
Dual specificity protein phosphatase (VHR) (Homo sapiens (Human))	BDBM50388819 (CHEMBL2062713) Show SMILES CCCCCCCCCCCCCCCC(NCc1ccccc1OC)=C1C(=O)OC(CO)C1=O |w:15.15| Show InChI InChI=1S/C29H45NO5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-24(27-28(32)26(22-31)35-29(27)33)30-21-23-18-16-17-20-25(23)34-2/h16-18,20,26,30-31H,3-15,19,21-22H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of VHR				ACS Med Chem Lett 3: 294-298 (2012) Article DOI: 10.1021/ml2002778 BindingDB Entry DOI: 10.7270/Q2ZW1N0H
					More data for this Ligand-Target Pair
Dual specificity phosphatase Cdc25B (Homo sapiens (Human))	BDBM50388819 (CHEMBL2062713) Show SMILES CCCCCCCCCCCCCCCC(NCc1ccccc1OC)=C1C(=O)OC(CO)C1=O |w:15.15| Show InChI InChI=1S/C29H45NO5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-24(27-28(32)26(22-31)35-29(27)33)30-21-23-18-16-17-20-25(23)34-2/h16-18,20,26,30-31H,3-15,19,21-22H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.21E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of CDC25B				ACS Med Chem Lett 3: 294-298 (2012) Article DOI: 10.1021/ml2002778 BindingDB Entry DOI: 10.7270/Q2ZW1N0H
					More data for this Ligand-Target Pair