Compile Data Set for Download or QSAR

Found 19 hits of ic50 for UniProtKB: P04021   

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
Envelope phospholipase F13 (Vaccinia virus (strain Western Reserve) (VACV) (Va...)	BDBM50577060 (SIGA-246 | ST 246 | ST-246 | Tecovirimat | Tpoxx) Show SMILES [H][C@]12C[C@@]1([H])[C@@]1([H])C=C[C@]2([H])[C@]2([H])C(=O)N(NC(=O)c3ccc(cc3)C(F)(F)F)C(=O)[C@]12[H] |r,c:8| Show InChI	MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.70	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113485 BindingDB Entry DOI: 10.7270/Q20G3Q08
					More data for this Ligand-Target Pair
Envelope phospholipase F13 (Vaccinia virus (strain Western Reserve) (VACV) (Va...)	BDBM50577042 (CHEMBL4864184) Show SMILES FC(F)(F)c1ccc(cc1)C(=O)NC12CC3CC(CC(C3)C1)C2 |TLB:12:13:16.15.20:18,THB:14:15:18:22.13.21,14:13:16.15.20:18,12:13:16:20.19.18,21:13:16:20.19.18,21:19:16:22.14.13| Show InChI	MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	133	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113485 BindingDB Entry DOI: 10.7270/Q20G3Q08
					More data for this Ligand-Target Pair
Envelope phospholipase F13 (Vaccinia virus (strain Western Reserve) (VACV) (Va...)	BDBM50577048 (CHEMBL4867155) Show SMILES FC(F)(F)c1ccc(cc1)C(=O)NC1C2CC3CC(C2)CC1C3 |TLB:22:21:17.16.15:19,THB:22:16:19:13.20.21,12:13:17.16.15:19,17:16:13:18.19.20,17:18:13:16.15.22,(26.21,-18.12,;24.88,-17.36,;24.87,-15.82,;26.2,-16.57,;23.54,-18.13,;22.21,-17.37,;20.88,-18.14,;20.88,-19.68,;22.21,-20.45,;23.55,-19.68,;19.54,-20.45,;19.54,-21.99,;18.21,-19.68,;16.88,-20.45,;16.87,-21.98,;15.47,-22.32,;14.14,-21.83,;12.94,-23.11,;14.45,-22.69,;15.85,-23.25,;14.43,-21.1,;15.48,-19.87,;14.13,-20.35,)| Show InChI	MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	216	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113485 BindingDB Entry DOI: 10.7270/Q20G3Q08
					More data for this Ligand-Target Pair
Envelope phospholipase F13 (Vaccinia virus (strain Western Reserve) (VACV) (Va...)	BDBM50577045 (CHEMBL4871145) Show SMILES FC(F)(F)c1ccc(cc1)C(=O)NCC12CC3CC(CC(C3)C1)C2 |TLB:13:14:17:21.20.19,THB:15:16:19:23.14.22,15:14:17.16.21:19,22:14:17:21.20.19,22:20:17:23.15.14| Show InChI	MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113485 BindingDB Entry DOI: 10.7270/Q20G3Q08
					More data for this Ligand-Target Pair
Envelope phospholipase F13 (Vaccinia virus (strain Western Reserve) (VACV) (Va...)	BDBM50577057 (CHEMBL4878636) Show SMILES CC(NNC(=O)c1ccc(cc1)C(F)(F)F)C12CC3CC(CC(C3)C1)C2 |TLB:1:16:19.18.23:21,THB:17:18:21:25.16.24,17:16:19.18.23:21,1:16:19:23.22.21,24:16:19:23.22.21,24:22:19:25.17.16| Show InChI	MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	515	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113485 BindingDB Entry DOI: 10.7270/Q20G3Q08
					More data for this Ligand-Target Pair
Envelope phospholipase F13 (Vaccinia virus (strain Western Reserve) (VACV) (Va...)	BDBM50577049 (CHEMBL4850454) Show SMILES FC(F)(F)c1ccc(cc1)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2 |TLB:14:16:19.18.23:21,THB:17:18:21:25.16.24,17:16:19.18.23:21,14:16:19:23.22.21,24:16:19:23.22.21,24:22:19:25.17.16| Show InChI	MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.07E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113485 BindingDB Entry DOI: 10.7270/Q20G3Q08
					More data for this Ligand-Target Pair
Envelope phospholipase F13 (Vaccinia virus (strain Western Reserve) (VACV) (Va...)	BDBM50577058 (CHEMBL4872088) Show SMILES CCC12CC3CC(C1)CC(C3)(C2)NNC(=O)c1ccc(cc1)C(F)(F)F |TLB:10:9:5.4.3:7,THB:10:4:7:8.9.11,12:9:5:3.2.7,12:9:5.4.3:7,1:2:5:8.10.9,11:9:5:3.2.7,11:2:5:8.10.9| Show InChI	MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.66E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113485 BindingDB Entry DOI: 10.7270/Q20G3Q08
					More data for this Ligand-Target Pair
Envelope phospholipase F13 (Vaccinia virus (strain Western Reserve) (VACV) (Va...)	BDBM50577054 (CHEMBL4857491) Show SMILES FC(F)(F)c1ccc(cc1)C(=O)NNC1C2CC3CC(C2)CC1C3 |TLB:20:19:23:16.15.14,20:15:18.19.21:23,THB:13:14:18.19.21:23,14:15:18:21.22.23,14:22:18:16.20.15,(50.85,-35.86,;50.85,-34.32,;52.18,-33.55,;52.17,-35.09,;49.51,-33.55,;48.18,-34.32,;46.84,-33.55,;46.84,-32.01,;48.17,-31.24,;49.51,-32,;45.51,-31.24,;45.51,-29.7,;44.18,-32.01,;42.84,-31.24,;41.51,-32.01,;41.5,-33.54,;40.1,-33.88,;38.77,-33.39,;37.58,-34.67,;39.08,-34.25,;40.48,-34.81,;39.07,-32.66,;40.11,-31.43,;38.77,-31.91,)| Show InChI	MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113485 BindingDB Entry DOI: 10.7270/Q20G3Q08
					More data for this Ligand-Target Pair
Envelope phospholipase F13 (Vaccinia virus (strain Western Reserve) (VACV) (Va...)	BDBM50577047 (CHEMBL4865942) Show SMILES Brc1ccc(cc1)C(=O)NC1C2CC3CC(C2)CC1C3 |TLB:19:18:14.13.12:16,THB:19:13:16:10.17.18,9:10:14.13.12:16,14:13:10:15.16.17,14:15:10:13.12.19,(12.3,-17.39,;10.97,-18.17,;10.97,-19.72,;9.64,-20.49,;8.3,-19.72,;8.3,-18.18,;9.63,-17.41,;6.97,-20.49,;6.97,-22.03,;5.63,-19.72,;4.3,-20.49,;4.29,-22.01,;2.89,-22.36,;1.56,-21.87,;.37,-23.15,;1.87,-22.73,;3.27,-23.29,;1.86,-21.14,;2.9,-19.91,;1.56,-20.39,)| Show InChI	MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.06E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113485 BindingDB Entry DOI: 10.7270/Q20G3Q08
					More data for this Ligand-Target Pair
Envelope phospholipase F13 (Vaccinia virus (strain Western Reserve) (VACV) (Va...)	BDBM50577055 (CHEMBL4852852) Show SMILES FC(F)(F)c1ccc(cc1)C(=O)NNC1C2CC3CC1CC(Cl)(C3)C2 |TLB:24:21:18:16.15.14,13:14:23.21.20:18,22:21:18:16.15.14,14:15:23:20.19.18,THB:24:15:23.21.20:18,14:19:23:16.24.15,(68.62,-36.56,;68.62,-35.02,;69.95,-34.25,;69.95,-35.79,;67.29,-34.25,;65.95,-35.02,;64.61,-34.25,;64.62,-32.71,;65.94,-31.94,;67.28,-32.7,;63.28,-31.94,;63.28,-30.4,;61.95,-32.71,;60.61,-31.94,;59.28,-32.71,;59.27,-34.24,;57.87,-34.58,;56.55,-34.09,;56.54,-32.61,;57.88,-32.13,;56.84,-33.36,;56.85,-34.95,;56.84,-36.49,;55.35,-35.37,;58.26,-35.51,)| Show InChI	MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.52E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113485 BindingDB Entry DOI: 10.7270/Q20G3Q08
					More data for this Ligand-Target Pair
Envelope phospholipase F13 (Vaccinia virus (strain Western Reserve) (VACV) (Va...)	BDBM50577043 (CHEMBL4879134) Show SMILES CCC12CC3CC(C1)CC(C3)(C2)NC(=O)c1ccc(cc1)C(F)(F)F |TLB:10:9:5.4.3:7,THB:10:4:7:8.9.11,12:9:5:3.2.7,12:9:5.4.3:7,1:2:5:8.10.9,11:9:5:3.2.7,11:2:5:8.10.9| Show InChI	MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113485 BindingDB Entry DOI: 10.7270/Q20G3Q08
					More data for this Ligand-Target Pair
Envelope phospholipase F13 (Vaccinia virus (strain Western Reserve) (VACV) (Va...)	BDBM50577044 (CHEMBL4877767) Show SMILES CN(C(=O)c1ccc(cc1)C(F)(F)F)C12CC3CC(CC(C3)C1)C2 |TLB:1:14:17.16.21:19,THB:15:16:19:23.14.22,15:14:17.16.21:19,1:14:17:21.20.19,22:14:17:21.20.19,22:20:17:23.15.14| Show InChI	MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.85E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113485 BindingDB Entry DOI: 10.7270/Q20G3Q08
					More data for this Ligand-Target Pair
Envelope phospholipase F13 (Vaccinia virus (strain Western Reserve) (VACV) (Va...)	BDBM50577046 (CHEMBL4860346) Show SMILES Brc1ccc(cc1)C(=O)NCC12CC3CC(CC(C3)C1)C2 |TLB:10:11:14:18.17.16,THB:12:13:16:20.11.19,12:11:14.13.18:16,19:11:14:18.17.16,19:17:14:20.12.11| Show InChI	MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113485 BindingDB Entry DOI: 10.7270/Q20G3Q08
					More data for this Ligand-Target Pair
Envelope phospholipase F13 (Vaccinia virus (strain Western Reserve) (VACV) (Va...)	BDBM50577059 (CHEMBL4856490) Show SMILES CC12CC3CC(C1)CC(C3)(C2)NC(=O)c1ccc(cc1)C(F)(F)F |TLB:9:8:4.3.2:6,THB:10:8:4:2.1.6,10:1:4:7.9.8,11:8:4:2.1.6,11:8:4.3.2:6,9:3:10.7.8:6,0:1:4:7.9.8| Show InChI	MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.98E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113485 BindingDB Entry DOI: 10.7270/Q20G3Q08
					More data for this Ligand-Target Pair
Envelope phospholipase F13 (Vaccinia virus (strain Western Reserve) (VACV) (Va...)	BDBM50577056 (CHEMBL4853135) Show SMILES C\C(=N/NC(=O)c1ccc(cc1)C(F)(F)F)C12CC3CC(CC(C3)C1)C2 |TLB:1:16:19.18.23:21,THB:17:18:21:25.16.24,17:16:19.18.23:21,1:16:19:23.22.21,24:16:19:23.22.21,24:22:19:25.17.16| Show InChI	MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.06E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113485 BindingDB Entry DOI: 10.7270/Q20G3Q08
					More data for this Ligand-Target Pair
Envelope phospholipase F13 (Vaccinia virus (strain Western Reserve) (VACV) (Va...)	BDBM50577051 (CHEMBL4865823) Show SMILES CCC12CC3CC(C1)CC(C3)(C2)C(=O)NNC(=O)c1ccc(cc1)C(F)(F)F |TLB:10:9:5.4.3:7,THB:10:4:7:8.9.11,12:9:5:3.2.7,12:9:5.4.3:7,11:9:5:3.2.7,11:2:5:8.10.9,1:2:5:8.10.9| Show InChI	MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.25E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113485 BindingDB Entry DOI: 10.7270/Q20G3Q08
					More data for this Ligand-Target Pair
Envelope phospholipase F13 (Vaccinia virus (strain Western Reserve) (VACV) (Va...)	BDBM50577050 (CHEMBL4873414) Show SMILES CC12CC3CC(C)(C1)CC(C3)(C2)C(=O)NNC(=O)c1ccc(cc1)C(F)(F)F |TLB:10:9:4.3.2:7,THB:10:3:7:8.9.11,12:9:4:2.1.7,12:9:4.3.2:7,11:9:4:2.1.7,11:1:4:8.10.9,0:1:4:8.10.9| Show InChI	MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.09E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113485 BindingDB Entry DOI: 10.7270/Q20G3Q08
					More data for this Ligand-Target Pair
Envelope phospholipase F13 (Vaccinia virus (strain Western Reserve) (VACV) (Va...)	BDBM50577052 (CHEMBL4866978) Show SMILES FC(F)(F)c1ccc(cc1)C(=O)NNC(=O)NC12CC3CC(CC(C3)C1)C2 |TLB:16:17:20:24.23.22,THB:18:19:22:26.17.25,18:17:20.19.24:22,25:17:20:24.23.22,25:23:20:26.18.17| Show InChI	MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.63E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113485 BindingDB Entry DOI: 10.7270/Q20G3Q08
					More data for this Ligand-Target Pair
Envelope phospholipase F13 (Vaccinia virus (strain Western Reserve) (VACV) (Va...)	BDBM50577053 (CHEMBL4876679) Show SMILES FC(F)(F)c1ccc(cc1)-[#6](=O)-[#7]\[#7]=[#6]-1/[#6]-2-[#6]-[#6]-3-[#6]-[#6](-[#6]2)-[#6]-[#6]-1-[#6]-3 |TLB:20:19:23:16.15.14,20:15:18.19.21:23,THB:13:14:18.19.21:23,14:15:18:21.22.23,14:22:18:16.20.15| Show InChI	MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.98E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of p37 in Vaccinia virus Copenhagen infected in African green monkey Vero cells assessed as reduction in viral reproduction incubated for ...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113485 BindingDB Entry DOI: 10.7270/Q20G3Q08
					More data for this Ligand-Target Pair