Compile Data Set for Download or QSAR

Found 6 hits of ic50 data for polymerid = 50004873   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Laccase (Trametes versicolor)	BDBM50357700 (PTILOMYCALIN A) Show 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 |r,t:55| Show InChI InChI=1S/C45H82N6O5/c1-3-38-24-16-17-28-44(56-38)35-37-26-27-39-41(45(29-21-23-36(2)55-45)49-43(48-44)51(37)39)42(53)54-34-20-14-12-10-8-6-4-5-7-9-11-13-15-25-40(52)50(33-22-31-47)32-19-18-30-46/h36-39,41H,3-35,46-47H2,1-2H3,(H,48,49)/p+1/t36-,37+,38+,39-,41-,44+,45-/m1/s1	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) Show 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 |r,t:55| Show InChI InChI=1S/C45H82N6O5/c1-3-38-24-16-17-28-44(56-38)35-37-26-27-39-41(45(29-21-23-36(2)55-45)49-43(48-44)51(37)39)42(53)54-34-20-14-12-10-8-6-4-5-7-9-11-13-15-25-40(52)50(33-22-31-47)32-19-18-30-46/h36-39,41H,3-35,46-47H2,1-2H3,(H,48,49)/p+1/t36-,37+,38+,39-,41-,44+,45-/m1/s1	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
Laccase (Trametes versicolor)	BDBM50357700 (PTILOMYCALIN A) Show 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 |r,t:55| Show InChI InChI=1S/C45H82N6O5/c1-3-38-24-16-17-28-44(56-38)35-37-26-27-39-41(45(29-21-23-36(2)55-45)49-43(48-44)51(37)39)42(53)54-34-20-14-12-10-8-6-4-5-7-9-11-13-15-25-40(52)50(33-22-31-47)32-19-18-30-46/h36-39,41H,3-35,46-47H2,1-2H3,(H,48,49)/p+1/t36-,37+,38+,39-,41-,44+,45-/m1/s1	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)	BDBM26985 (2-triaza-1,2-diyne | CHEMBL79455 | CHEMBL89295 | N...) Show SMILES [N-]=[N+]=[N-] Show InChI InChI=1S/N3/c1-3-2/q-1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	2.57E+5	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
Laccase (Trametes versicolor)	BDBM26985 (2-triaza-1,2-diyne | CHEMBL79455 | CHEMBL89295 | N...) Show SMILES [N-]=[N+]=[N-] Show InChI InChI=1S/N3/c1-3-2/q-1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	2.63E+5	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)	BDBM26985 (2-triaza-1,2-diyne | CHEMBL79455 | CHEMBL89295 | N...) Show SMILES [N-]=[N+]=[N-] Show InChI InChI=1S/N3/c1-3-2/q-1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	2.79E+5	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