Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetGag-Pol polyprotein [489-587]
LigandBDBM50091605
Substrate/Competitorn/a
Meas. Tech.ChEMBL_159325 (CHEMBL769378)
IC50 3.4±n/a nM
Citation Dorsey, BDMcDonough, CMcDaniel, SLLevin, RBNewton, CLHoffman, JMDarke, PLZugay-Murphy, JAEmini, EASchleif, WAOlsen, DBStahlhut, MWRutkowski, CAKuo, LCLin, JHChen, IWMichelson, SRHolloway, MKHuff, JRVacca, JP Identification of MK-944a: a second clinical candidate from the hydroxylaminepentanamide isostere series of HIV protease inhibitors. J Med Chem43:3386-99 (2000) [PubMed]
More Info.:Get all data from this article,  Assay Method
 
Gag-Pol polyprotein [489-587]
Name:Gag-Pol polyprotein [489-587]
Synonyms:Human immunodeficiency virus type 1 protease | POL_HV1H2 | Pol polyprotein | gag-pol
Type:Enzyme Subunit
Mol. Mass.:10781.16
Organism:Human immunodeficiency virus type 1
Description:P04585[489-587]
Residue:99
Sequence:
PQVTLWQRPLVTIKIGGQLKEALLDTGADDTVLEEMSLPGRWKPKMIGGIGGFIKVRQYD
QILIEICGHKAIGTVLVGPTPVNIIGRNLLTQIGCTLNF
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50091605
n/a
NameBDBM50091605
Synonyms:4-(6-Ethoxy-pyridin-3-ylmethyl)-1-[2-hydroxy-4-(2-hydroxy-indan-1-ylcarbamoyl)-5-phenyl-pentyl]-piperazine-2-carboxylic acid tert-butylamide | CHEMBL325267
TypeSmall organic molecule
Emp. Form.C38H51N5O5
Mol. Mass.657.842
SMILESCCOc1ccc(CN2CCN(C[C@@H](O)C[C@@H](Cc3ccccc3)C(=O)NC3[C@H](O)Cc4ccccc34)[C@@H](C2)C(=O)NC(C)(C)C)cn1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: