BDBM50357700 PTILOMYCALIN A
SMILES: CC[C@H]1CCCC[C@@]2(C[C@@H]3CC[C@@H]4[C@H](C(=O)OCCCCCCCCCCCCCCCC(=O)N(CCCN)CCCCN)[C@]5(CCC[C@@H](C)O5)NC(N2)=[N+]34)O1
InChI Key: InChIKey=XCQKBLKCMOARAT-COYUCOOOSA-O
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Laccase (Trametes versicolor) | BDBM50357700 (PTILOMYCALIN A) | PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | 4.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of California Curated by ChEMBL | Assay Description Inhibition of Trametes versicolor laccase assessed as production of dopachrome using 100 uM epinephrine as substrate preincubated for 30 mins before ... | Bioorg Med Chem 19: 6654-7 (2011) Article DOI: 10.1016/j.bmc.2011.05.041 BindingDB Entry DOI: 10.7270/Q2SJ1M1J | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Laccase (Trametes versicolor) | BDBM50357700 (PTILOMYCALIN A) | PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | 5.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of California Curated by ChEMBL | Assay Description Inhibition of Trametes versicolor laccase assessed as production of dopachrome using 300 uM L-dopa as substrate preincubated for 30 mins before subst... | Bioorg Med Chem 19: 6654-7 (2011) Article DOI: 10.1016/j.bmc.2011.05.041 BindingDB Entry DOI: 10.7270/Q2SJ1M1J | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Laccase (Trametes versicolor) | BDBM50357700 (PTILOMYCALIN A) | PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | 4.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of California Curated by ChEMBL | Assay Description Inhibition of Trametes versicolor laccase assessed as production of dopachrome using 200 uM dopamine as substrate preincubated for 30 mins before sub... | Bioorg Med Chem 19: 6654-7 (2011) Article DOI: 10.1016/j.bmc.2011.05.041 BindingDB Entry DOI: 10.7270/Q2SJ1M1J | |||||||||||
More data for this Ligand-Target Pair |