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Compile Data Set for Download or QSAR

Found 5 hits of kd data for polymerid = 50004612   
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
Peptidase


(Staphylococcus aureus)
BDBM50569542
PNG
(CHEMBL4847813)
Show SMILES Cc1ccc(NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)C2CCN(CC2)C(=O)CNC(=O)OC(C)(C)C)cc1 |r|
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 129n/an/an/an/an/a


TBA

Assay Description
Binding affinity to Staphylococcus aureus PBP2a assessed as equilibrium dissociation constant by SPR assay


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128001
BindingDB Entry DOI: 10.7270/Q2GT5RZS
More data for this
Ligand-Target Pair
Peptidase


(Staphylococcus aureus)
BDBM50569544
PNG
(CHEMBL4879273)
Show SMILES COc1cc2CC[C@H](NC(C)=O)c3cc(=O)c(NCC(=O)NCCc4c[nH]c5ccccc45)ccc3-c2c(OC)c1OC |r|
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 168n/an/an/an/an/a


TBA

Assay Description
Binding affinity to Staphylococcus aureus PBP2a assessed as equilibrium dissociation constant by SPR assay


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128001
BindingDB Entry DOI: 10.7270/Q2GT5RZS
More data for this
Ligand-Target Pair
Peptidase


(Staphylococcus aureus)
BDBM50569543
PNG
(CHEMBL4862632)
Show SMILES COc1ccc(cc1)-c1cc(=O)oc2c(C)c(OCC(=O)N[C@@H](Cc3c[nH]c4ccc(O)cc34)C(O)=O)ccc12 |r|
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 264n/an/an/an/an/a


TBA

Assay Description
Binding affinity to Staphylococcus aureus PBP2a assessed as equilibrium dissociation constant by SPR assay


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128001
BindingDB Entry DOI: 10.7270/Q2GT5RZS
More data for this
Ligand-Target Pair
Peptidase


(Staphylococcus aureus)
BDBM50611996
PNG
(CHEMBL5274536)
Show SMILES [H][C@@]12CC[C@@]34C[C@@]5(C)C=C(C(=O)OC)[C@@]33CO[C@@]4(O[C@@]3(C)CC5=O)[C@@]1([H])C=CC(=O)C2(C)C |r,c:31,t:8,TLB:8:6:17.18:14,23:22:17.18:14,7:6:17.18:14,10:9:19.22.21:4.5,3:4:9.8:19.22.21,18:19:9.8:4.5,THB:23:22:9.8:4.5,17:4:9.8:19.22.21|
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
UniChem
n/an/an/a 1.84E+4n/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Peptidase


(Staphylococcus aureus)
BDBM50569545
PNG
(CHEMBL4871381)
Show SMILES COc1ccc(NC(=O)[C@H]2Oc3c([C@@H]2c2ccc(CCCN4CCCC4=O)cc2)c(=O)oc2ccccc32)cc1 |r|
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 8.66E+4n/an/an/an/an/a


TBA

Assay Description
Binding affinity to Staphylococcus aureus PBP2a assessed as equilibrium dissociation constant by SPR assay


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128001
BindingDB Entry DOI: 10.7270/Q2GT5RZS
More data for this
Ligand-Target Pair