BDBM82190 Salicylic acid derivative, compound 2
SMILES: Cc1ccc(C)n1-c1ccc(O)c(c1)C(O)=O
InChI Key: InChIKey=LBDOGIZEEBHJSE-UHFFFAOYSA-N
Data: 6 IC50
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 |
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EPHA4 (Homo sapiens (Human)) | BDBM82190 (Salicylic acid derivative, compound 2) | PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | Purchase MCE PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 1.00E+4 | n/a | n/a | n/a | n/a | 7.5 | n/a |
Sanford-Burnham Medical Research Institute | Assay Description Protein A-coasted wells (from Pierce Biotechnology) were used to immobilize Eph receptor Fc fusion proteins (from R&D systems)incubated at 1 ug/ml in... | Chem Biol Drug Des 78: 667-78 (2011) Article DOI: 10.1111/j.1747-0285.2011.01199.x BindingDB Entry DOI: 10.7270/Q2FN14QN | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Pyruvate kinase (PKM2) (Homo sapiens (Human)) | BDBM82190 (Salicylic acid derivative, compound 2) | PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase MCE PC cid PC sid UniChem Patents Similars | US Patent | n/a | n/a | 7.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Beth Israel Deaconess Medical Center, Inc. US Patent | Assay Description Primary screening was performed using PKM2 in the presence of FBP. Compounds were chosen as potential "hits" if the compound demonstrated inhibition ... | US Patent US8877791 (2014) BindingDB Entry DOI: 10.7270/Q2D21WBN | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
10 kDa chaperonin (Escherichia coli) | BDBM82190 (Salicylic acid derivative, compound 2) | PDB UniProtKB/TrEMBL GoogleScholar AffyNet | Purchase MCE PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 620 | n/a | n/a | n/a | n/a | n/a | n/a |
Indiana University Curated by ChEMBL | Assay Description Inhibition of Escherichia coli GroEL/GroES expressed in Escherichia coli DH5alpha/BL21 (DE3) assessed as inhibition of denatured MDH refolding preinc... | Bioorg Med Chem Lett 24: 786-9 (2014) Article DOI: 10.1016/j.bmcl.2013.12.100 BindingDB Entry DOI: 10.7270/Q27D2Z3M | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Pyruvate kinase (PKM2) (Homo sapiens (Human)) | BDBM82190 (Salicylic acid derivative, compound 2) | PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase MCE PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 1.25E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Guizhou Medical University Curated by ChEMBL | Assay Description Inhibition of recombinant human N-terminal His6/SUMO-tagged PKM2 expressed in Escherichia coli BL21 using PEP as substrate incubated for 30 mins in p... | Bioorg Med Chem Lett 27: 5404-5408 (2017) Article DOI: 10.1016/j.bmcl.2017.11.011 BindingDB Entry DOI: 10.7270/Q2V40XS7 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
10 kDa chaperonin (Escherichia coli) | BDBM82190 (Salicylic acid derivative, compound 2) | PDB UniProtKB/TrEMBL GoogleScholar AffyNet | Purchase MCE PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | >2.50E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Indiana University Curated by ChEMBL | Assay Description Inhibition of Escherichia coli GroEL/GroES-ATPase activity expressed in Escherichia coli DH5alpha/BL21 (DE3) assessed as inhibition of denatured MDH ... | Bioorg Med Chem Lett 24: 786-9 (2014) Article DOI: 10.1016/j.bmcl.2013.12.100 BindingDB Entry DOI: 10.7270/Q27D2Z3M | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Pyruvate kinase (PKM2) (Homo sapiens (Human)) | BDBM82190 (Salicylic acid derivative, compound 2) | PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase MCE PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Guizhou Medical University Curated by ChEMBL | Assay Description Inhibition of recombinant human N-terminal His6/SUMO-tagged PKM1 expressed in Escherichia coli BL21 using PEP as substrate incubated for 30 mins in p... | Bioorg Med Chem Lett 27: 5404-5408 (2017) Article DOI: 10.1016/j.bmcl.2017.11.011 BindingDB Entry DOI: 10.7270/Q2V40XS7 | |||||||||||
More data for this Ligand-Target Pair |