UCSF

ZINC03982103

Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2005 35 No

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.37 1.35 -87.24 2 5 0 73 496.717 12

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
FNTA-1-E Protein Farnesyltransferase/geranylgeranyltransferase Type I Alpha Subunit (cluster #1 Of 3), Eukaryotic Eukaryotes 1 0.36 Binding ≤ 10μM
FNTB-1-E Protein Farnesyltransferase Beta Subunit (cluster #1 Of 3), Eukaryotic Eukaryotes 1 0.36 Binding ≤ 10μM
Z50597-1-O Rattus Norvegicus (cluster #1 Of 12), Other Other 12 0.32 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
FNTB_RAT Q02293 Protein Farnesyltransferase Beta Subunit, Rat 0.87 0.36 Binding ≤ 1μM
FNTA_RAT Q04631 Protein Farnesyltransferase/geranylgeranyltransferase Type I Alpha Subunit, Rat 0.87 0.36 Binding ≤ 1μM
FNTB_RAT Q02293 Protein Farnesyltransferase Beta Subunit, Rat 0.87 0.36 Binding ≤ 10μM
FNTA_RAT Q04631 Protein Farnesyltransferase/geranylgeranyltransferase Type I Alpha Subunit, Rat 0.87 0.36 Binding ≤ 10μM
Z50597 Z50597 Rattus Norvegicus 12 0.32 Functional ≤ 10μM

Reactome Annotations from Targets (via Uniprot)

Description Species
Inactivation, recovery and regulation of the phototransduction cascade

Analogs ( Draw Identity 99% 90% 80% 70% )