BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 11 hits Enz. Inhib. hit(s) with Target = 'ATP Phosphoribosyltransferase' AND taxid = 83332   
Target
(Institution)
LigandTarget
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
ATP Phosphoribosyltransferase


(Mycobacterium tuberculosis)
BDBM25314
PNG
(2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-(1...)
Show SMILES O=C(CSc1nnc(-c2ccccc2)c(n1)-c1ccccc1)Nc1nccs1
Show InChI InChI=1S/C20H15N5OS2/c26-16(22-19-21-11-12-27-19)13-28-20-23-17(14-7-3-1-4-8-14)18(24-25-20)15-9-5-2-6-10-15/h1-12H,13H2,(H,21,22,26)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 4.00E+3n/an/an/an/a8.522



Yale University



Assay Description
Inhibition activity was determined using an assay that followed the production of PR-ATP spectrophotometrically. Enzymatic reaction was initiated by ...


Citation and Details
More data for this
Ligand-Target Pair
ATP Phosphoribosyltransferase


(Mycobacterium tuberculosis)
BDBM25322
PNG
(2-bromo-3,5-dinitro-N-[(phenylcarbamoyl)amino]benz...)
Show SMILES [O-][N+](=O)c1cc(C(=O)NNC(=O)Nc2ccccc2)c(Br)c(c1)[N+]([O-])=O
Show InChI InChI=1S/C14H10BrN5O6/c15-12-10(6-9(19(23)24)7-11(12)20(25)26)13(21)17-18-14(22)16-8-4-2-1-3-5-8/h1-7H,(H,17,21)(H2,16,18,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 5.50E+3n/an/an/an/a8.522



Yale University



Assay Description
Inhibition activity was determined using an assay that followed the production of PR-ATP spectrophotometrically. Enzymatic reaction was initiated by ...


Citation and Details
More data for this
Ligand-Target Pair
ATP Phosphoribosyltransferase


(Mycobacterium tuberculosis)
BDBM25316
PNG
(ChemBridge nitrobenzothiazole, 6 | N-(6-nitro-1,3-...)
Show SMILES [O-][N+](=O)c1ccc2nc(NC(=O)CC(NC(=O)c3ccccc3)c3ccccc3)sc2c1
Show InChI InChI=1S/C23H18N4O4S/c28-21(26-23-25-18-12-11-17(27(30)31)13-20(18)32-23)14-19(15-7-3-1-4-8-15)24-22(29)16-9-5-2-6-10-16/h1-13,19H,14H2,(H,24,29)(H,25,26,28)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 6.00E+3n/an/an/an/a8.522



Yale University



Assay Description
Inhibition activity was determined using an assay that followed the production of PR-ATP spectrophotometrically. Enzymatic reaction was initiated by ...


Citation and Details
More data for this
Ligand-Target Pair
ATP Phosphoribosyltransferase


(Mycobacterium tuberculosis)
BDBM25318
PNG
((4-methoxyphenyl)methyl 2-methyl-5-oxo-4,7-bis(thi...)
Show SMILES COc1ccc(COC(=O)C2=C(C)N=C3CC(CC(=O)C3C2c2cccs2)c2cccs2)cc1
Show InChI InChI=1S/C27H25NO4S2/c1-16-24(27(30)32-15-17-7-9-19(31-2)10-8-17)26(23-6-4-12-34-23)25-20(28-16)13-18(14-21(25)29)22-5-3-11-33-22/h3-12,18,25-26H,13-15H2,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 1.00E+4n/an/an/an/a8.522



Yale University



Assay Description
Inhibition activity was determined using an assay that followed the production of PR-ATP spectrophotometrically. Enzymatic reaction was initiated by ...


Citation and Details
More data for this
Ligand-Target Pair
ATP Phosphoribosyltransferase


(Mycobacterium tuberculosis)
BDBM25317
PNG
(3-hydroxy-4-[(E)-2-(1-hydroxynaphthalen-2-yl)diaze...)
Show SMILES Oc1cc(c2cc(ccc2c1N=Nc1ccc2ccccc2c1O)[N+]([O-])=O)S(O)(=O)=O
Show InChI InChI=1S/C20H13N3O7S/c24-17-10-18(31(28,29)30)15-9-12(23(26)27)6-7-14(15)19(17)22-21-16-8-5-11-3-1-2-4-13(11)20(16)25/h1-10,24-25H,(H,28,29,30)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents


Similars

AffyNet 
Article
PubMed
n/an/a 1.00E+4n/an/an/an/a8.522



Yale University



Assay Description
Inhibition activity was determined using an assay that followed the production of PR-ATP spectrophotometrically. Enzymatic reaction was initiated by ...


Citation and Details
More data for this
Ligand-Target Pair
ATP Phosphoribosyltransferase


(Mycobacterium tuberculosis)
BDBM25323
PNG
(2-({7-[(3-hydroxyphenyl)amino]-4-nitro-2,1,3-benzo...)
Show SMILES Oc1cccc(Nc2cc(Nc3ccc(cc3O)[N+]([O-])=O)c([N+]([O-])=O)c3nonc23)c1
Show InChI InChI=1S/C18H12N6O7/c25-11-3-1-2-9(6-11)19-13-8-14(18(24(29)30)17-16(13)21-31-22-17)20-12-5-4-10(23(27)28)7-15(12)26/h1-8,19-20,25-26H
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/a 1.19E+4n/an/an/an/a8.522



Yale University



Assay Description
Inhibition activity was determined using an assay that followed the production of PR-ATP spectrophotometrically. Enzymatic reaction was initiated by ...


Citation and Details
More data for this
Ligand-Target Pair
ATP Phosphoribosyltransferase


(Mycobacterium tuberculosis)
BDBM25324
PNG
(ChemBridge nitrobenzothiazole, 19 | ethyl 0-[(6-ni...)
Show SMILES CCOC(=O)C(=O)Nc1nc2ccc(cc2s1)[N+]([O-])=O
Show InChI InChI=1S/C11H9N3O5S/c1-2-19-10(16)9(15)13-11-12-7-4-3-6(14(17)18)5-8(7)20-11/h3-5H,2H2,1H3,(H,12,13,15)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 1.39E+4n/an/an/an/a8.522



Yale University



Assay Description
Inhibition activity was determined using an assay that followed the production of PR-ATP spectrophotometrically. Enzymatic reaction was initiated by ...


Citation and Details
More data for this
Ligand-Target Pair
ATP Phosphoribosyltransferase


(Mycobacterium tuberculosis)
BDBM25325
PNG
(2-[methyl(6-nitro-1,3-benzothiazol-2-yl)amino]acet...)
Show SMILES CN(CC(O)=O)c1nc2ccc(cc2s1)[N+]([O-])=O
Show InChI InChI=1S/C10H9N3O4S/c1-12(5-9(14)15)10-11-7-3-2-6(13(16)17)4-8(7)18-10/h2-4H,5H2,1H3,(H,14,15)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/an/an/an/an/an/a8.522



Yale University



Assay Description
Inhibition activity was determined using an assay that followed the production of PR-ATP spectrophotometrically. Enzymatic reaction was initiated by ...


Citation and Details
More data for this
Ligand-Target Pair
ATP Phosphoribosyltransferase


(Mycobacterium tuberculosis)
BDBM25320
PNG
(4-[(E)-2-{2,6-diamino-3-methyl-5-[(E)-2-(4-sulfoph...)
Show SMILES Cc1cc(\N=N\c2ccc(cc2)S(O)(=O)=O)c(N)c(\N=N\c2ccc(cc2)S(O)(=O)=O)c1N
Show InChI InChI=1S/C19H18N6O6S2/c1-11-10-16(24-22-12-2-6-14(7-3-12)32(26,27)28)18(21)19(17(11)20)25-23-13-4-8-15(9-5-13)33(29,30)31/h2-10H,20-21H2,1H3,(H,26,27,28)(H,29,30,31)/b24-22+,25-23+
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/an/an/an/an/an/a8.522



Yale University



Assay Description
Inhibition activity was determined using an assay that followed the production of PR-ATP spectrophotometrically. Enzymatic reaction was initiated by ...


Citation and Details
More data for this
Ligand-Target Pair
ATP Phosphoribosyltransferase


(Mycobacterium tuberculosis)
BDBM25321
PNG
((4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-1-(p...)
Show SMILES COc1cc(cc(OC)c1OC)C1C(C(=O)c2ccc(Cl)cc2)C(=O)C(=O)N1Cc1cccnc1
Show InChI InChI=1S/C26H23ClN2O6/c1-33-19-11-17(12-20(34-2)25(19)35-3)22-21(23(30)16-6-8-18(27)9-7-16)24(31)26(32)29(22)14-15-5-4-10-28-13-15/h4-13,21-22H,14H2,1-3H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/an/an/an/an/an/a8.522



Yale University



Assay Description
Inhibition activity was determined using an assay that followed the production of PR-ATP spectrophotometrically. Enzymatic reaction was initiated by ...


Citation and Details
More data for this
Ligand-Target Pair
ATP Phosphoribosyltransferase


(Mycobacterium tuberculosis)
BDBM25319
PNG
(4,6-bis(benzylsulfanyl)pyrimidine-2,5-diamine | Ch...)
Show SMILES Nc1nc(SCc2ccccc2)c(N)c(SCc2ccccc2)n1
Show InChI InChI=1S/C18H18N4S2/c19-15-16(23-11-13-7-3-1-4-8-13)21-18(20)22-17(15)24-12-14-9-5-2-6-10-14/h1-10H,11-12,19H2,(H2,20,21,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
AffyNet 
Article
PubMed
n/an/an/an/an/an/an/a8.522



Yale University



Assay Description
Inhibition activity was determined using an assay that followed the production of PR-ATP spectrophotometrically. Enzymatic reaction was initiated by ...


Citation and Details
More data for this
Ligand-Target Pair