BDBM50339553 (2S,5S,8S,11S)-14-(bicyclo[2.2.1]heptan-2-yl)-11-(2-carboxyethyl)-8-((R)-1-hydroxyethyl)-2-isopropyl-5-methyl-4,7,10-trioxo-3,6,9,12-tetraazatetradecan-1-oic acid::CHEMBL1688617
SMILES: CC(C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NCCC1CC2CCC1C2)[C@@H](C)O)C(O)=O
InChI Key: InChIKey=BQLARHIUYSAOHF-QKDVZYMOSA-N
Data: 2 KI
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Disks large homolog 4 (Homo sapiens (Human)) | BDBM50339553 ((2S,5S,8S,11S)-14-(bicyclo[2.2.1]heptan-2-yl)-11-(...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 1.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Copenhagen Curated by ChEMBL | Assay Description Inhibition of PSD-95 PDZ2 domain by competitive fluorescence polarization assay | J Med Chem 54: 1333-46 (2011) Article DOI: 10.1021/jm1013924 BindingDB Entry DOI: 10.7270/Q2H13300 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Disks large homolog 4 (Homo sapiens (Human)) | BDBM50339553 ((2S,5S,8S,11S)-14-(bicyclo[2.2.1]heptan-2-yl)-11-(...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 1.40E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Copenhagen Curated by ChEMBL | Assay Description Inhibition of PSD-95 PDZ3 domain by competitive fluorescence polarization assay | J Med Chem 54: 1333-46 (2011) Article DOI: 10.1021/jm1013924 BindingDB Entry DOI: 10.7270/Q2H13300 | |||||||||||
More data for this Ligand-Target Pair |