BDBM54754 3-[(4-ketocyclohexa-2,5-dien-1-ylidene)methyl]-2,4-dihydro-1H-cyclopenta[b]quinoline-9-carboxylic acid::3-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]-2,4-dihydro-1H-cyclopenta[b]quinoline-9-carboxylic acid::3-[(4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-2,4-dihydro-1H-cyclopenta[b]quinoline-9-carboxylic acid::3-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-2,4-dihydro-1H-cyclopenta[b]quinoline-9-carboxylic acid::MLS000776136::SMR000371150::cid_5908804
SMILES: OC(=O)c1c2CCC(=Cc3ccc(O)cc3)c2nc2ccccc12
InChI Key: InChIKey=RLRNPHISVAQKAJ-UHFFFAOYSA-N
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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neuronal munc18-1 binding protein (Rattus norvegicus) | BDBM54754 (3-[(4-ketocyclohexa-2,5-dien-1-ylidene)methyl]-2,4...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 1.84E+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 (2009) BindingDB Entry DOI: 10.7270/Q20P0XFH | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Beta-adrenergic receptor kinase 1 (Homo sapiens (Human)) | BDBM54754 (3-[(4-ketocyclohexa-2,5-dien-1-ylidene)methyl]-2,4...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | n/a | n/a | 3.33E+4 | n/a | n/a | n/a | n/a |
NMMLSC Curated by PubChem BioAssay | Assay Description University of New Mexico Assay Overview: Assay Support: 1 R03 DA030557-01A1 Project Title: RNA Aptamer-based screen for Selective Inhibitors of ... | PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2B56H72 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Voltage-gated calcium channel subunit alpha Cav2.2 (Homo sapiens (Human)) | BDBM54754 (3-[(4-ketocyclohexa-2,5-dien-1-ylidene)methyl]-2,4...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 3.85E+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: Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute Network... | PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2PZ578V | |||||||||||
More data for this Ligand-Target Pair |