BDBM20715 (2S)-N-[(2S,3S,4S,5S)-1,6-dicyclohexyl-3,4-dihydroxy-5-[(2S)-3-methyl-2-{[methyl(pyridin-2-ylmethyl)carbamoyl]amino}butanamido]hexan-2-yl]-3-methyl-2-{[methyl(pyridin-2-ylmethyl)carbamoyl]amino}butanamide::Inhibitor CC

SMILES CC(C)[C@H](NC(=O)N(C)Cc1ccccn1)C(=O)N[C@@H](CC1CCCCC1)[C@H](O)[C@@H](O)[C@H](CC1CCCCC1)NC(=O)[C@@H](NC(=O)N(C)Cc1ccccn1)C(C)C

InChI Key InChIKey=GOFBMDJZIXCQGV-UNHORJANSA-N

Data  2 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 20715   

TargetDimer of Gag-Pol polyprotein [489-587](Human immunodeficiency virus type 1)
Universidad De Santiago De Compostela

LigandPNGBDBM20715((2S)-N-[(2S,3S,4S,5S)-1,6-dicyclohexyl-3,4-dihydro...)
Affinity DataKi:  6nM ΔG°:  -11.7kcal/molepH: 4.7 T: 2°CAssay Description:The inhibition constants Ki were determined by monitoring the inhibition of hydrolysis of the chromogenic substrate using a Hewlett-Packard 8452A spe...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetDimer of Gag-Pol polyprotein [489-587,V571A](Human immunodeficiency virus type 1)
Universidad De Santiago De Compostela

LigandPNGBDBM20715((2S)-N-[(2S,3S,4S,5S)-1,6-dicyclohexyl-3,4-dihydro...)
Affinity DataKi:  12nM ΔG°:  -11.2kcal/molepH: 4.7 T: 2°CAssay Description:The inhibition constants Ki were determined by monitoring the inhibition of hydrolysis of the chromogenic substrate using a Hewlett-Packard 8452A spe...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed