null

SMILES Oc1c(Br)cc(cc1Br)C1(OC(=O)c2cccc3cccc1c23)c1cc(Br)c(O)c(Br)c1

InChI Key InChIKey=RJTQNRRVLFIIEV-UHFFFAOYSA-N

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 18768   

TargetThymidylate synthase(Lactobacillus casei)
UNIMORE

LigandPNGBDBM18768(1,8-naphthalein derivative, 15 | 4,4-bis(3,5-dibro...)copy SMILEScopy InChI
Affinity DataKi:  900nM ΔG°:  -8.10kcal/molepH: 7.4 T: 2°CAssay Description:TS was assayed spectrophotometrically in the reaction buffer solution containing (6R, 6S)-5, 10-CH2H4folate. The reaction was initiated by the additi...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2S180R0PubMed
TargetThymidylate synthase(Homo sapiens (Human))
UNIMORE

LigandPNGBDBM18768(1,8-naphthalein derivative, 15 | 4,4-bis(3,5-dibro...)copy SMILEScopy InChI
Affinity DataKi:  3.20E+3nMAssay Description:TS was assayed spectrophotometrically in the reaction buffer solution containing (6R, 6S)-5, 10-CH2H4folate. The reaction was initiated by the additi...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2S180R0PubMed
TargetThymidylate synthase(Cryptococcus neoformans)
UNIMORE

LigandPNGBDBM18768(1,8-naphthalein derivative, 15 | 4,4-bis(3,5-dibro...)copy SMILEScopy InChI
Affinity DataKi:  4.00E+3nMAssay Description:TS was assayed spectrophotometrically in the reaction buffer solution containing (6R, 6S)-5, 10-CH2H4folate. The reaction was initiated by the additi...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2S180R0PubMed
TargetDihydrofolate reductase(Homo sapiens (Human))
UNIMORE

LigandPNGBDBM18768(1,8-naphthalein derivative, 15 | 4,4-bis(3,5-dibro...)copy SMILEScopy InChI
Affinity DataKi:  9.50E+3nMAssay Description:DHFRs were assayed spectrophotometrically in the reaction buffer solution containing dihydrofolate. The reaction was initiated with an amount of enzy...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2S180R0PubMed
TargetThymidylate synthase(Escherichia coli)
UNIMORE

LigandPNGBDBM18768(1,8-naphthalein derivative, 15 | 4,4-bis(3,5-dibro...)copy SMILEScopy InChI
Affinity DataKi: >1.10E+7nMAssay Description:TS was assayed spectrophotometrically in the reaction buffer solution containing (6R, 6S)-5, 10-CH2H4folate. The reaction was initiated by the additi...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2S180R0PubMed