BDBM50281644 CHEMBL355867::N*1*-[(1S,2S,4S)-1-Cyclohexylmethyl-4-(2,2-dimethyl-propylcarbamoyl)-2-hydroxy-5-methyl-hexyl]-2-[(quinoline-2-carbonyl)-amino]-succinamide
SMILES: CC(C)[C@H](C[C@H](O)[C@H](CC1CCCCC1)NC(=O)C(CC(N)=O)NC(=O)c1ccc2ccccc2n1)C(=O)NCC(C)(C)C
InChI Key: InChIKey=YFPJVAMWHSOWMB-GLVGJZHTSA-N
Data: 1 KI
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Human immunodeficiency virus type 1 protease (Human immunodeficiency virus type 1) | BDBM50281644 (CHEMBL355867 | N*1*-[(1S,2S,4S)-1-Cyclohexylmethyl...) | PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article | 14 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Evaluated for inhibitory activity against HIV-1 protease | Bioorg Med Chem Lett 3: 819-824 (1993) Article DOI: 10.1016/S0960-894X(00)80673-3 BindingDB Entry DOI: 10.7270/Q2NS0VCQ | |||||||||||
More data for this Ligand-Target Pair |