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Compile Data Set for Download or QSAR

Found 27 hits Enz. Inhib. hit(s) with all data for entry = 50040544   
Target/Host
(Institution)
LigandTarget/Host
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
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)
BDBM50395921
PNG
(CHEMBL2164511)
Show SMILES C[C@@](CCc1cc(on1)-c1ccccc1)(C(=O)NO)S(C)(=O)=O |r|
Show InChI InChI=1S/C15H18N2O5S/c1-15(14(18)16-19,23(2,20)21)9-8-12-10-13(22-17-12)11-6-4-3-5-7-11/h3-7,10,19H,8-9H2,1-2H3,(H,16,18)/t15-/m1/s1
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 0.511n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa LpxC


Bioorg Med Chem Lett 22: 6832-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.058
BindingDB Entry DOI: 10.7270/Q2GF0VMV
More data for this
Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)
BDBM50395911
PNG
(CHEMBL2164521)
Show SMILES C[C@@](CCn1cc(nn1)-c1ccc(Cl)cc1F)(C(=O)NO)S(C)(=O)=O |r|
Show InChI InChI=1S/C14H16ClFN4O4S/c1-14(13(21)18-22,25(2,23)24)5-6-20-8-12(17-19-20)10-4-3-9(15)7-11(10)16/h3-4,7-8,22H,5-6H2,1-2H3,(H,18,21)/t14-/m1/s1
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 0.657n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa LpxC


Bioorg Med Chem Lett 22: 6832-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.058
BindingDB Entry DOI: 10.7270/Q2GF0VMV
More data for this
Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)
BDBM50395920
PNG
(CHEMBL2164512)
Show SMILES C[C@@](CCn1cc(nn1)-c1ccccc1)(C(=O)NO)S(C)(=O)=O |r|
Show InChI InChI=1S/C14H18N4O4S/c1-14(13(19)16-20,23(2,21)22)8-9-18-10-12(15-17-18)11-6-4-3-5-7-11/h3-7,10,20H,8-9H2,1-2H3,(H,16,19)/t14-/m1/s1
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 0.850n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa LpxC


Bioorg Med Chem Lett 22: 6832-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.058
BindingDB Entry DOI: 10.7270/Q2GF0VMV
More data for this
Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)
BDBM50395910
PNG
(CHEMBL2164522)
Show SMILES C[C@@](CCn1cc(nn1)-c1ccc(Cl)c(F)c1)(C(=O)NO)S(C)(=O)=O |r|
Show InChI InChI=1S/C14H16ClFN4O4S/c1-14(13(21)18-22,25(2,23)24)5-6-20-8-12(17-19-20)9-3-4-10(15)11(16)7-9/h3-4,7-8,22H,5-6H2,1-2H3,(H,18,21)/t14-/m1/s1
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 0.912n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa LpxC


Bioorg Med Chem Lett 22: 6832-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.058
BindingDB Entry DOI: 10.7270/Q2GF0VMV
More data for this
Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)
BDBM50395909
PNG
(CHEMBL2164523)
Show SMILES COc1ccc(-c2cn(CC[C@](C)(C(=O)NO)S(C)(=O)=O)nn2)c(F)c1 |r|
Show InChI InChI=1S/C15H19FN4O5S/c1-15(14(21)18-22,26(3,23)24)6-7-20-9-13(17-19-20)11-5-4-10(25-2)8-12(11)16/h4-5,8-9,22H,6-7H2,1-3H3,(H,18,21)/t15-/m1/s1
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 1.20n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa LpxC


Bioorg Med Chem Lett 22: 6832-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.058
BindingDB Entry DOI: 10.7270/Q2GF0VMV
More data for this
Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)
BDBM50395908
PNG
(CHEMBL2164524)
Show SMILES Cc1ccc(cc1)-c1cn(CC[C@](C)(C(=O)NO)S(C)(=O)=O)nn1 |r|
Show InChI InChI=1S/C15H20N4O4S/c1-11-4-6-12(7-5-11)13-10-19(18-16-13)9-8-15(2,14(20)17-21)24(3,22)23/h4-7,10,21H,8-9H2,1-3H3,(H,17,20)/t15-/m1/s1
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.39n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa LpxC


Bioorg Med Chem Lett 22: 6832-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.058
BindingDB Entry DOI: 10.7270/Q2GF0VMV
More data for this
Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)
BDBM50395919
PNG
(CHEMBL2164513)
Show SMILES C[C@@](CCn1cc(cn1)-c1ccccc1)(C(=O)NO)S(C)(=O)=O |r|
Show InChI InChI=1S/C15H19N3O4S/c1-15(14(19)17-20,23(2,21)22)8-9-18-11-13(10-16-18)12-6-4-3-5-7-12/h3-7,10-11,20H,8-9H2,1-2H3,(H,17,19)/t15-/m1/s1
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.61n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa LpxC


Bioorg Med Chem Lett 22: 6832-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.058
BindingDB Entry DOI: 10.7270/Q2GF0VMV
More data for this
Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)
BDBM50395907
PNG
(CHEMBL2164525)
Show SMILES C[C@@](CCn1cc(nn1)-c1ccc(Cl)c(Cl)c1)(C(=O)NO)S(C)(=O)=O |r|
Show InChI InChI=1S/C14H16Cl2N4O4S/c1-14(13(21)18-22,25(2,23)24)5-6-20-8-12(17-19-20)9-3-4-10(15)11(16)7-9/h3-4,7-8,22H,5-6H2,1-2H3,(H,18,21)/t14-/m1/s1
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 1.67n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa LpxC


Bioorg Med Chem Lett 22: 6832-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.058
BindingDB Entry DOI: 10.7270/Q2GF0VMV
More data for this
Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)
BDBM50395906
PNG
(CHEMBL2164526)
Show SMILES C[C@@](CCn1cc(nn1)-c1ccc(F)c(F)c1)(C(=O)NO)S(C)(=O)=O |r|
Show InChI InChI=1S/C14H16F2N4O4S/c1-14(13(21)18-22,25(2,23)24)5-6-20-8-12(17-19-20)9-3-4-10(15)11(16)7-9/h3-4,7-8,22H,5-6H2,1-2H3,(H,18,21)/t14-/m1/s1
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 1.87n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa LpxC


Bioorg Med Chem Lett 22: 6832-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.058
BindingDB Entry DOI: 10.7270/Q2GF0VMV
More data for this
Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)
BDBM50395905
PNG
(CHEMBL2164184)
Show SMILES C[C@@](CCn1cc(nn1)-c1cccc(Cl)c1Cl)(C(=O)NO)S(C)(=O)=O |r|
Show InChI InChI=1S/C14H16Cl2N4O4S/c1-14(13(21)18-22,25(2,23)24)6-7-20-8-11(17-19-20)9-4-3-5-10(15)12(9)16/h3-5,8,22H,6-7H2,1-2H3,(H,18,21)/t14-/m1/s1
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 1.95n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa LpxC


Bioorg Med Chem Lett 22: 6832-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.058
BindingDB Entry DOI: 10.7270/Q2GF0VMV
More data for this
Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)
BDBM50395902
PNG
(CHEMBL2164187)
Show SMILES COc1ccc(-c2cc(CC[C@](C)(C(=O)NO)S(C)(=O)=O)no2)c(F)c1 |r|
Show InChI InChI=1S/C16H19FN2O6S/c1-16(15(20)18-21,26(3,22)23)7-6-10-8-14(25-19-10)12-5-4-11(24-2)9-13(12)17/h4-5,8-9,21H,6-7H2,1-3H3,(H,18,20)/t16-/m1/s1
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 2.32n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa LpxC


Bioorg Med Chem Lett 22: 6832-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.058
BindingDB Entry DOI: 10.7270/Q2GF0VMV
More data for this
Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)
BDBM50395901
PNG
(CHEMBL2164188)
Show SMILES CC(CCc1cc(on1)-c1cccc(Cl)c1Cl)(C(=O)NO)S(C)(=O)=O
Show InChI InChI=1S/C15H16Cl2N2O5S/c1-15(14(20)18-21,25(2,22)23)7-6-9-8-12(24-19-9)10-4-3-5-11(16)13(10)17/h3-5,8,21H,6-7H2,1-2H3,(H,18,20)
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 2.66n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa LpxC


Bioorg Med Chem Lett 22: 6832-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.058
BindingDB Entry DOI: 10.7270/Q2GF0VMV
More data for this
Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)
BDBM50395898
PNG
(CHEMBL2164191)
Show SMILES Cc1ccc(cc1)-c1cc(CCC(C)(C(=O)NO)S(C)(=O)=O)on1
Show InChI InChI=1S/C16H20N2O5S/c1-11-4-6-12(7-5-11)14-10-13(23-18-14)8-9-16(2,15(19)17-20)24(3,21)22/h4-7,10,20H,8-9H2,1-3H3,(H,17,19)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.93n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa LpxC


Bioorg Med Chem Lett 22: 6832-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.058
BindingDB Entry DOI: 10.7270/Q2GF0VMV
More data for this
Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)
BDBM50395917
PNG
(CHEMBL2164515)
Show SMILES CC(CCc1cn(nn1)-c1ccccc1)(C(=O)NO)S(C)(=O)=O
Show InChI InChI=1S/C14H18N4O4S/c1-14(13(19)16-20,23(2,21)22)9-8-11-10-18(17-15-11)12-6-4-3-5-7-12/h3-7,10,20H,8-9H2,1-2H3,(H,16,19)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa LpxC


Bioorg Med Chem Lett 22: 6832-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.058
BindingDB Entry DOI: 10.7270/Q2GF0VMV
More data for this
Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)
BDBM50395918
PNG
(CHEMBL2164514)
Show SMILES C[C@@](CCc1cc(no1)-c1ccccc1)(C(=O)NO)S(C)(=O)=O |r|
Show InChI InChI=1S/C15H18N2O5S/c1-15(14(18)16-19,23(2,20)21)9-8-12-10-13(17-22-12)11-6-4-3-5-7-11/h3-7,10,19H,8-9H2,1-2H3,(H,16,18)/t15-/m1/s1
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 3.02n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa LpxC


Bioorg Med Chem Lett 22: 6832-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.058
BindingDB Entry DOI: 10.7270/Q2GF0VMV
More data for this
Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)
BDBM50395897
PNG
(CHEMBL2164192)
Show SMILES COc1ccc(-c2cc(CC[C@](C)(C(=O)NO)S(C)(=O)=O)on2)c(F)c1 |r|
Show InChI InChI=1S/C16H19FN2O6S/c1-16(15(20)18-21,26(3,22)23)7-6-11-9-14(19-25-11)12-5-4-10(24-2)8-13(12)17/h4-5,8-9,21H,6-7H2,1-3H3,(H,18,20)/t16-/m1/s1
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

Article
PubMed
n/an/a 4.40n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa LpxC


Bioorg Med Chem Lett 22: 6832-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.058
BindingDB Entry DOI: 10.7270/Q2GF0VMV
More data for this
Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)
BDBM50395904
PNG
(CHEMBL2164185)
Show SMILES COc1ccc(-c2cn(CC[C@](C)(C(=O)NO)S(C)(=O)=O)nn2)c(Cl)c1 |r|
Show InChI InChI=1S/C15H19ClN4O5S/c1-15(14(21)18-22,26(3,23)24)6-7-20-9-13(17-19-20)11-5-4-10(25-2)8-12(11)16/h4-5,8-9,22H,6-7H2,1-3H3,(H,18,21)/t15-/m1/s1
PDB
MMDB

UniProtKB/TrEMBL

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PC sid
UniChem

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Article
PubMed
n/an/a 4.71n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa LpxC


Bioorg Med Chem Lett 22: 6832-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.058
BindingDB Entry DOI: 10.7270/Q2GF0VMV
More data for this
Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)
BDBM50395896
PNG
(CHEMBL2164193)
Show SMILES COc1cccc(-c2cc(CC[C@](C)(C(=O)NO)S(C)(=O)=O)on2)c1F |r|
Show InChI InChI=1S/C16H19FN2O6S/c1-16(15(20)18-21,26(3,22)23)8-7-10-9-12(19-25-10)11-5-4-6-13(24-2)14(11)17/h4-6,9,21H,7-8H2,1-3H3,(H,18,20)/t16-/m1/s1
PDB
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UniProtKB/TrEMBL

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DrugBank
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Article
PubMed
n/an/a 5.32n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa LpxC


Bioorg Med Chem Lett 22: 6832-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.058
BindingDB Entry DOI: 10.7270/Q2GF0VMV
More data for this
Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)
BDBM50395900
PNG
(CHEMBL2164189)
Show SMILES CC(CCc1cc(on1)-c1cccc(F)c1)(C(=O)NO)S(C)(=O)=O
Show InChI InChI=1S/C15H17FN2O5S/c1-15(14(19)17-20,24(2,21)22)7-6-12-9-13(23-18-12)10-4-3-5-11(16)8-10/h3-5,8-9,20H,6-7H2,1-2H3,(H,17,19)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
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PC sid
UniChem

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Article
PubMed
n/an/a 6.75n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa LpxC


Bioorg Med Chem Lett 22: 6832-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.058
BindingDB Entry DOI: 10.7270/Q2GF0VMV
More data for this
Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)
BDBM50395895
PNG
(CHEMBL2164194)
Show SMILES CC(CCc1cc(no1)-c1cccc(F)c1F)(C(=O)NO)S(C)(=O)=O
Show InChI InChI=1S/C15H16F2N2O5S/c1-15(14(20)18-21,25(2,22)23)7-6-9-8-12(19-24-9)10-4-3-5-11(16)13(10)17/h3-5,8,21H,6-7H2,1-2H3,(H,18,20)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
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PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.81n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa LpxC


Bioorg Med Chem Lett 22: 6832-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.058
BindingDB Entry DOI: 10.7270/Q2GF0VMV
More data for this
Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)
BDBM50395903
PNG
(CHEMBL2164186)
Show SMILES C[C@@](CCn1cc(nn1)-c1cccc(F)c1F)(C(=O)NO)S(C)(=O)=O |r|
Show InChI InChI=1S/C14H16F2N4O4S/c1-14(13(21)18-22,25(2,23)24)6-7-20-8-11(17-19-20)9-4-3-5-10(15)12(9)16/h3-5,8,22H,6-7H2,1-2H3,(H,18,21)/t14-/m1/s1
PDB
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UniProtKB/TrEMBL

B.MOAD
DrugBank
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CHEMBL
PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 8.08n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa LpxC


Bioorg Med Chem Lett 22: 6832-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.058
BindingDB Entry DOI: 10.7270/Q2GF0VMV
More data for this
Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)
BDBM50395899
PNG
(CHEMBL2164190)
Show SMILES CC(CCc1cc(on1)-c1ccccc1F)(C(=O)NO)S(C)(=O)=O
Show InChI InChI=1S/C15H17FN2O5S/c1-15(14(19)17-20,24(2,21)22)8-7-10-9-13(23-18-10)11-5-3-4-6-12(11)16/h3-6,9,20H,7-8H2,1-2H3,(H,17,19)
PDB
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Article
PubMed
n/an/a 8.31n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa LpxC


Bioorg Med Chem Lett 22: 6832-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.058
BindingDB Entry DOI: 10.7270/Q2GF0VMV
More data for this
Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)
BDBM50395916
PNG
(CHEMBL2164516)
Show SMILES CC(CCc1cnn(c1)-c1ccccc1)(C(=O)NO)S(C)(=O)=O
Show InChI InChI=1S/C15H19N3O4S/c1-15(14(19)17-20,23(2,21)22)9-8-12-10-16-18(11-12)13-6-4-3-5-7-13/h3-7,10-11,20H,8-9H2,1-2H3,(H,17,19)
PDB
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PubMed
n/an/a 13.5n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa LpxC


Bioorg Med Chem Lett 22: 6832-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.058
BindingDB Entry DOI: 10.7270/Q2GF0VMV
More data for this
Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)
BDBM50395914
PNG
(CHEMBL2164518)
Show SMILES CC(CCc1nc(no1)-c1ccccc1)(C(=O)NO)S(C)(=O)=O
Show InChI InChI=1S/C14H17N3O5S/c1-14(13(18)16-19,23(2,20)21)9-8-11-15-12(17-22-11)10-6-4-3-5-7-10/h3-7,19H,8-9H2,1-2H3,(H,16,18)
PDB
MMDB

UniProtKB/TrEMBL

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DrugBank
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PubMed
n/an/a>100n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa LpxC


Bioorg Med Chem Lett 22: 6832-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.058
BindingDB Entry DOI: 10.7270/Q2GF0VMV
More data for this
Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)
BDBM50395915
PNG
(CHEMBL2164517)
Show SMILES CC(CCc1nnc([nH]1)-c1ccccc1)(C(=O)NO)S(C)(=O)=O
Show InChI InChI=1S/C14H18N4O4S/c1-14(13(19)18-20,23(2,21)22)9-8-11-15-12(17-16-11)10-6-4-3-5-7-10/h3-7,20H,8-9H2,1-2H3,(H,18,19)(H,15,16,17)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
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PC cid
PC sid
UniChem
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PubMed
n/an/a>100n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa LpxC


Bioorg Med Chem Lett 22: 6832-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.058
BindingDB Entry DOI: 10.7270/Q2GF0VMV
More data for this
Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)
BDBM50395912
PNG
(CHEMBL2164520)
Show SMILES CC(CCn1ncc(n1)-c1ccccc1)(C(=O)NO)S(C)(=O)=O
Show InChI InChI=1S/C14H18N4O4S/c1-14(13(19)17-20,23(2,21)22)8-9-18-15-10-12(16-18)11-6-4-3-5-7-11/h3-7,10,20H,8-9H2,1-2H3,(H,17,19)
PDB
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UniProtKB/TrEMBL

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DrugBank
GoogleScholar
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a>100n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa LpxC


Bioorg Med Chem Lett 22: 6832-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.058
BindingDB Entry DOI: 10.7270/Q2GF0VMV
More data for this
Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)
BDBM50395913
PNG
(CHEMBL2164519)
Show SMILES CC(CCc1cc(n[nH]1)-c1ccccc1)(C(=O)NO)S(C)(=O)=O
Show InChI InChI=1S/C15H19N3O4S/c1-15(14(19)18-20,23(2,21)22)9-8-12-10-13(17-16-12)11-6-4-3-5-7-11/h3-7,10,20H,8-9H2,1-2H3,(H,16,17)(H,18,19)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>100n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa LpxC


Bioorg Med Chem Lett 22: 6832-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.058
BindingDB Entry DOI: 10.7270/Q2GF0VMV
More data for this
Ligand-Target Pair