BDBM171372 US9085571, Table 1, Compound 20
SMILES: COc1ccc(cc1)S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc(C)cc(c1)C(=O)N(C)Cc1nc(C)oc1C
InChI Key: InChIKey=VYTQZAGDUBREEP-QWOOXDRHSA-N
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Protease (Human immunodeficiency virus 1 (HIV-1)) | BDBM171372 (US9085571, Table 1, Compound 20) | PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | PC cid PC sid PDB UniChem Similars | US Patent | 0.200 | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
Purdue Research Foundation US Patent | Assay Description Without being bound by theory, it is suggested that the compounds described herein may exert their utility by the inhibition of proteases encoded by ... | US Patent US9085571 (2015) BindingDB Entry DOI: 10.7270/Q2N01590 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Protease (Human immunodeficiency virus 1 (HIV-1)) | BDBM171372 (US9085571, Table 1, Compound 20) | PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | PC cid PC sid PDB UniChem Similars | Article PubMed | 0.210 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Purdue University Curated by ChEMBL | Assay Description Inhibition of HIV-1 protease by fluorometric assay | Bioorg Med Chem Lett 25: 4903-4909 (2015) Article DOI: 10.1016/j.bmcl.2015.05.052 BindingDB Entry DOI: 10.7270/Q2P84FW4 | |||||||||||
More data for this Ligand-Target Pair |