BDBM50067478 CHEMBL3400659
SMILES: [H][C@]12[C@]3([H])C=C(CO)C[C@]4(O)C(=O)C(C)=C[C@@]4([H])[C@@]3(O)[C@H](C)[C@@H](OC(=O)c3ccccc3)[C@@]1(OC(=O)C(C)CC)C2(C)C
InChI Key: InChIKey=PSGAPHBVGGCVMS-RDUJSUARSA-N
Data: 2 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Cyclooxygenase (Homo sapiens (Human)) | BDBM50067478 (CHEMBL3400659) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | n/a | n/a | 8.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hunan University of Chinese Medicine Curated by ChEMBL | Assay Description Inhibition of human recombinant COX2 using fluorometric substrate after 15 mins | Bioorg Med Chem Lett 25: 1986-9 (2015) Article DOI: 10.1016/j.bmcl.2015.03.017 BindingDB Entry DOI: 10.7270/Q27946CT | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Prostaglandin G/H synthase (cyclooxygenase) (Ovis aries (Sheep)) | BDBM50067478 (CHEMBL3400659) | PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | n/a | n/a | 140 | n/a | n/a | n/a | n/a | n/a | n/a |
Hunan University of Chinese Medicine Curated by ChEMBL | Assay Description Inhibition of ovine COX1 using fluorometric substrate after 15 mins | Bioorg Med Chem Lett 25: 1986-9 (2015) Article DOI: 10.1016/j.bmcl.2015.03.017 BindingDB Entry DOI: 10.7270/Q27946CT | |||||||||||
More data for this Ligand-Target Pair |