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SMILES: CSCC[C@H](NC(=O)c1cccc(CN(Cc2cnc[nH]2)Cc2cnc[nH]2)c1)C(O)=O

InChI Key: InChIKey=JAKMEGXFQJPDDB-IBGZPJMESA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50079671   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Geranylgeranyl transferase type-1 subunit beta/Protein farnesyltransferase/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50079671
PNG
((S)-2-(3-{[Bis-(1H-imidazol-4-ylmethyl)-amino]-met...)
Show SMILES CSCC[C@H](NC(=O)c1cccc(CN(Cc2cnc[nH]2)Cc2cnc[nH]2)c1)C(O)=O
Show InChI InChI=1S/C21H26N6O3S/c1-31-6-5-19(21(29)30)26-20(28)16-4-2-3-15(7-16)10-27(11-17-8-22-13-24-17)12-18-9-23-14-25-18/h2-4,7-9,13-14,19H,5-6,10-12H2,1H3,(H,22,24)(H,23,25)(H,26,28)(H,29,30)/t19-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 1.70E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of geranyl geranyl transferase I (GGTase-I)


Bioorg Med Chem Lett 9: 1991-6 (1999)


BindingDB Entry DOI: 10.7270/Q2ZG6RFB
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50079671
PNG
((S)-2-(3-{[Bis-(1H-imidazol-4-ylmethyl)-amino]-met...)
Show SMILES CSCC[C@H](NC(=O)c1cccc(CN(Cc2cnc[nH]2)Cc2cnc[nH]2)c1)C(O)=O
Show InChI InChI=1S/C21H26N6O3S/c1-31-6-5-19(21(29)30)26-20(28)16-4-2-3-15(7-16)10-27(11-17-8-22-13-24-17)12-18-9-23-14-25-18/h2-4,7-9,13-14,19H,5-6,10-12H2,1H3,(H,22,24)(H,23,25)(H,26,28)(H,29,30)/t19-/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 870n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of [3H]-FPP incorporation into recombinant Ha-Ras by bovine brain farensyltransferase


Bioorg Med Chem Lett 9: 1991-6 (1999)


BindingDB Entry DOI: 10.7270/Q2ZG6RFB
More data for this
Ligand-Target Pair