BDBM50464769 CHEMBL4290098

SMILES CC(C)=CCc1c(O)ccc(C(=O)[C@@H]2[C@@H](c3ccc(O)cc3O)CC(C)=C[C@H]2c2c(O)cc(O)c3c(=O)c(CC=C(C)C)c(-c4ccc(O)cc4O)oc23)c1O

InChI Key InChIKey=PHNIIIBGRKZKSS-UHFFFAOYSA-N

Data  1 KI  6 IC50  2 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 9 hits for monomerid = 50464769   

TargetTYR_PHOSPHATASE_2 domain-containing protein(Mycobacterium tuberculosis (strain CDC 1551 / Oshk...)
Universidade Federal De Santa Catarina

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50464769BDBM50464769(CHEMBL4290098)
Affinity DataKi:  200nMAssay Description:Inhibition of Mycobacterium tuberculosis PtpB using p-nitrophenyl phosphate as substrate preincubated for 10 mins followed by substrate addition meas...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/18/2020
Entry Details Article
PubMed
TargetTYR_PHOSPHATASE_2 domain-containing protein(Mycobacterium tuberculosis (strain CDC 1551 / Oshk...)
Universidade Federal De Santa Catarina

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50464769BDBM50464769(CHEMBL4290098)
Affinity DataIC50: 360nMAssay Description:Inhibition of Mycobacterium tuberculosis PtpB using p-nitrophenyl phosphate as substrate preincubated for 10 mins followed by substrate addition meas...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/18/2020
Entry Details Article
PubMed
TargetTYR_PHOSPHATASE_2 domain-containing protein(Mycobacterium tuberculosis (strain CDC 1551 / Oshk...)
Universidade Federal De Santa Catarina

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50464769BDBM50464769(CHEMBL4290098)
Affinity DataIC50: 363nMAssay Description:Inhibition of Mycobacterium tuberculosis PtpB using p-nitrophenyl phosphate as substrate preincubated for 10 mins followed by substrate addition meas...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/18/2020
Entry Details Article
PubMed
TargetTYR_PHOSPHATASE_2 domain-containing protein(Mycobacterium tuberculosis (strain CDC 1551 / Oshk...)
Universidade Federal De Santa Catarina

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50464769BDBM50464769(CHEMBL4290098)
Affinity DataKd:  850nMAssay Description:Binding affinity to Mycobacterium tuberculosis PtpB by fluorescence based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/18/2020
Entry Details Article
PubMed
TargetTYR_PHOSPHATASE_2 domain-containing protein(Mycobacterium tuberculosis (strain CDC 1551 / Oshk...)
Universidade Federal De Santa Catarina

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50464769BDBM50464769(CHEMBL4290098)
Affinity DataKd:  1.00E+3nMAssay Description:Binding affinity to Mycobacterium tuberculosis PtpB by UV-VIS spectrophotometric analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/18/2020
Entry Details Article
PubMed
TargetLow molecular weight protein-tyrosine phosphatase A(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
Universidade Federal De Santa Catarina

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50464769BDBM50464769(CHEMBL4290098)
Affinity DataIC50: 1.49E+3nMAssay Description:Inhibition of Mycobacterium tuberculosis PtpA using p-nitrophenyl phosphate as substrate preincubated for 10 mins followed by substrate addition meas...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/18/2020
Entry Details Article
PubMed
TargetTyrosine-protein phosphatase non-receptor type 1(Human)
Universidade Federal De Santa Catarina

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50464769BDBM50464769(CHEMBL4290098)
Affinity DataIC50: 2.54E+3nMAssay Description:Inhibition of human PTP1B using p-nitrophenyl phosphate as substrate preincubated for 10 mins followed by substrate addition measured every minute fo...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/18/2020
Entry Details Article
PubMed
TargetTyrosine-protein phosphatase non-receptor type 12(Human)
Universidade Federal De Santa Catarina

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50464769BDBM50464769(CHEMBL4290098)
Affinity DataIC50: 5.22E+3nMAssay Description:Inhibition of PTP-PEST (unknown origin) using p-nitrophenyl phosphate as substrate preincubated for 10 mins followed by substrate addition measured e...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/18/2020
Entry Details Article
PubMed
TargetTyrosine-protein phosphatase non-receptor type 22(Human)
Universidade Federal De Santa Catarina

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50464769BDBM50464769(CHEMBL4290098)
Affinity DataIC50: 1.18E+4nMAssay Description:Inhibition of LYP (unknown origin) using p-nitrophenyl phosphate as substrate preincubated for 10 mins followed by substrate addition measured every ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/18/2020
Entry Details Article
PubMed