BDBM50027126 2,15,17,29-tetrahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-26-(Azacyclotridec-1-yl)-methylene-amino-6,23-dioxo-8,30-dioxa-24-azatetracyclo[23.3.1.14,7.05,28]triaconta-1(28),2,4,9,19,21,25(29),26-octaen-13-yl acetate::26-(1-azacyclotridecanyliminomethyl)-2,15,17,29-tetrahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-6,23-dioxo-8,30-dioxa-24-azatetracyclo[23.3.1.14,7.05,28]triaconta-1(28),2,4,9,19,21,25(29),26-octaen-13-yl acetate::CHEMBL446676

SMILES COC1/C=C/OC2(C)Oc3c(C)c(O)c4c(O)c(c(/C=N/N5CCCCCCCCCCCC5)cc4c3C2=O)NC(=O)/C(C)=C\C=C\C(C)C(O)C(C)C(O)C(C)C(OC(C)=O)C1C

InChI Key InChIKey=WLCJTWRWXNTRET-UHFFFAOYSA-N

Data  1 KI  2 IC50

  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 3 hits for monomerid = 50027126   

TargetGag-Pol polyprotein(WMSV)
TBA

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50027126BDBM50027126(2,15,17,29-tetrahydroxy-11-methoxy-3,7,12,14,16,18...)
Affinity DataIC50: 3.30E+3nMAssay Description:Ability to inhibit simian sarcoma virus reverse transcriptaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetDNA polymerase beta(Mouse)
TBA

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50027126BDBM50027126(2,15,17,29-tetrahydroxy-11-methoxy-3,7,12,14,16,18...)
Affinity DataIC50: 1.90E+4nMAssay Description:Ability to inhibit mouse beta DNA polymeraseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetGag-Pol polyprotein(WMSV)
TBA

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50027126BDBM50027126(2,15,17,29-tetrahydroxy-11-methoxy-3,7,12,14,16,18...)
Affinity DataKi:  3.31E+8nMAssay Description:Ability to inhibit simian virus reverse transcriptase, expressed as log Ki.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed