BDBM50106245 2-{4-hydroxy-3-hydroxymethyl-2-(3-hydroxypropyl)-4-methyl-3-[4-methyl-6-(2,5,6,6-tetramethyl-2-cyclohexenyl)-(3Z,5E)-3,5-hexadienyl]cyclohexyliden}propanal::CHEMBL339911
SMILES: C[C@H]1CC=C(C)[C@@H](\C=C\C(\C)=C/CC[C@@]2(CO)[C@H](CCCO)\C(CC[C@]2(C)O)=C(\C)C=O)C1(C)C
InChI Key: InChIKey=CUWJDZXEDIUEEW-ULBXKDFISA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
RAS guanyl releasing protein 3 (Homo sapiens (Human)) | BDBM50106245 (2-{4-hydroxy-3-hydroxymethyl-2-(3-hydroxypropyl)-4...) | Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | PubMed | 16 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Michigan Cancer Center Curated by ChEMBL | Assay Description Binding affinity for RasGPR3, guanine nucleotide exchange factor | J Med Chem 44: 3872-80 (2001) BindingDB Entry DOI: 10.7270/Q2Z037F5 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Protein kinase C alpha type (Homo sapiens (Human)) | BDBM50106245 (2-{4-hydroxy-3-hydroxymethyl-2-(3-hydroxypropyl)-4...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | PubMed | 76 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Michigan Cancer Center Curated by ChEMBL | Assay Description Binding affinity for PKC alpha (C1b domain) | J Med Chem 44: 3872-80 (2001) BindingDB Entry DOI: 10.7270/Q2Z037F5 | |||||||||||
More data for this Ligand-Target Pair |