BDBM61188 4-[5-(4-methylphenyl)-3-[3-(4-methylphenyl)-1-phenyl-4-pyrazolyl]-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid::4-[5-(4-methylphenyl)-3-[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]-3,4-dihydropyrazol-2-yl]-4-oxidanylidene-butanoic acid::4-[5-(4-methylphenyl)-3-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid::4-keto-4-[5-[1-phenyl-3-(p-tolyl)pyrazol-4-yl]-3-(p-tolyl)-2-pyrazolin-1-yl]butyric acid::MLS000680473::SMR000324613::US9533969, TDRL-520::cid_5055219
SMILES: Cc1ccc(cc1)C1=NN(C(C1)c1cn(nc1-c1ccc(C)cc1)-c1ccccc1)C(=O)CCC(O)=O
InChI Key: InChIKey=UCLQPKSPVFQXNS-UHFFFAOYSA-N
Data: 3 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
SUMO-conjugating enzyme UBC9 (Homo sapiens (Human)) | BDBM61188 (4-[5-(4-methylphenyl)-3-[3-(4-methylphenyl)-1-phen...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 4.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Burnham Center for Chemical Genomics Curated by PubChem BioAssay | Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C... | PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2V986G8 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Replication protein A 70 kDa DNA-binding subunit (Homo sapiens (Human)) | BDBM61188 (4-[5-(4-methylphenyl)-3-[3-(4-methylphenyl)-1-phen...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | US Patent | n/a | n/a | 2.03E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Indiana University Research and Technology Corporation US Patent | Assay Description Small molecule inhibitors were obtained from ChemDiv and resuspended in DMSO. Compound TDLR-505 was independently synthesized and structure confirmed... | US Patent US9533969 (2017) BindingDB Entry DOI: 10.7270/Q2445KDJ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
SUMO-activating enzyme subunit 1 (Homo sapiens (Human)) | BDBM61188 (4-[5-(4-methylphenyl)-3-[3-(4-methylphenyl)-1-phen...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 2.02E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Burnham Center for Chemical Genomics Curated by PubChem BioAssay | Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C... | PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2BP0175 | |||||||||||
More data for this Ligand-Target Pair |