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Target
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Ki
IC50
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EC50
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Found
17
hits Enz. Inhib. hit(s) with all data for assayid = 15 entry = 50019148
Target/Host
(Institution)
Ligand
Target/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
k
off
s
-1
k
on
M
-1
s
-1
pH
Temp
°C
Amine oxidase [flavin-containing] A
(Homo sapiens (Human))
BDBM50615742
(CHEMBL5269241)
Show SMILES
CNC(=S)N1N=C(CC1c1ccc(F)cc1)c1ccccc1 |c:5|
Show InChI
PDB
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GoogleScholar
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PC cid
PC sid
UniChem
0.100
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Citation and Details
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A
(Homo sapiens (Human))
BDBM50615757
(CHEMBL5270226)
Show SMILES
Cc1ccc(cc1)C1=NN(C(C1)c1ccc(F)cc1)C(=S)NCC=C |t:8|
Show InChI
PDB
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antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
0.100
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Citation and Details
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A
(Homo sapiens (Human))
BDBM50615743
(CHEMBL5283319)
Show SMILES
CNC(=S)N1N=C(CC1c1ccc(F)cc1)c1ccc(Cl)cc1 |c:5|
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
0.100
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Citation and Details
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A
(Homo sapiens (Human))
BDBM50615744
(CHEMBL5276967)
Show SMILES
CNC(=S)N1N=C(CC1c1ccc(F)cc1)c1ccc(C)cc1 |c:5|
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
0.100
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Citation and Details
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A
(Homo sapiens (Human))
BDBM50615745
(CHEMBL5272518)
Show SMILES
CNC(=S)N1N=C(CC1c1ccc(F)cc1)c1ccc(OC)cc1 |c:5|
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
0.100
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Citation and Details
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A
(Homo sapiens (Human))
BDBM50615746
(CHEMBL5291452)
Show SMILES
CCNC(=S)N1N=C(CC1c1ccc(F)cc1)c1ccccc1 |c:6|
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
0.100
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Citation and Details
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A
(Homo sapiens (Human))
BDBM50615747
(CHEMBL5280524)
Show SMILES
CCNC(=S)N1N=C(CC1c1ccc(F)cc1)c1ccc(Cl)cc1 |c:6|
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
0.100
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Citation and Details
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A
(Homo sapiens (Human))
BDBM50615748
(CHEMBL5272772)
Show SMILES
CCNC(=S)N1N=C(CC1c1ccc(F)cc1)c1ccc(C)cc1 |c:6|
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
0.100
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Citation and Details
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A
(Homo sapiens (Human))
BDBM50615749
(CHEMBL5271570)
Show SMILES
CCNC(=S)N1N=C(CC1c1ccc(F)cc1)c1ccc(OC)cc1 |c:6|
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
0.100
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Citation and Details
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A
(Homo sapiens (Human))
BDBM50615750
(CHEMBL5268306)
Show SMILES
Fc1ccc(cc1)C1CC(=NN1C(=S)Nc1ccccc1)c1ccccc1 |c:10|
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
0.100
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Citation and Details
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A
(Homo sapiens (Human))
BDBM50615751
(CHEMBL5273835)
Show SMILES
COc1ccc(cc1)C1=NN(C(C1)c1ccc(F)cc1)C(=S)Nc1ccccc1 |t:9|
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
0.100
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Citation and Details
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A
(Homo sapiens (Human))
BDBM50615752
(CHEMBL5284012)
Show SMILES
Fc1ccc(cc1)C1CC(=NN1C(=S)Nc1ccccc1)c1ccc(Cl)cc1 |c:10|
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
0.100
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Citation and Details
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A
(Homo sapiens (Human))
BDBM50615753
(CHEMBL5275680)
Show SMILES
Fc1ccc(cc1)C1CC(=NN1C(=S)NCC=C)c1ccccc1 |c:10|
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
0.100
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Citation and Details
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A
(Homo sapiens (Human))
BDBM50615754
(CHEMBL5290358)
Show SMILES
Fc1ccc(cc1)C1CC(=NN1C(=S)NCC=C)c1ccc(Cl)cc1 |c:10|
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
0.100
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Citation and Details
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A
(Homo sapiens (Human))
BDBM50615755
(CHEMBL5284128)
Show SMILES
COc1ccc(cc1)C1=NN(C(C1)c1ccc(F)cc1)C(=S)NCC=C |t:9|
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
0.100
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Citation and Details
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A
(Homo sapiens (Human))
BDBM50615756
(CHEMBL5282135)
Show SMILES
Cc1ccc(cc1)C1=NN(C(C1)c1ccc(F)cc1)C(=S)Nc1ccccc1 |t:8|
Show InChI
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
0.100
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Citation and Details
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A
(Homo sapiens (Human))
BDBM15613
(4-chloro-N-(2-morpholin-4-ylethyl)benzamide | 4-ch...)
Show SMILES
Clc1ccc(cc1)C(=O)NCCN1CCOCC1
Show InChI
InChI=1S/C13H17ClN2O2/c14-12-3-1-11(2-4-12)13(17)15-5-6-16-7-9-18-10-8-16/h1-4H,5-10H2,(H,15,17)
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
DrugBank
MCE
PC cid
PC sid
UniChem
Patents
0.5
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Citation and Details
More data for this
Ligand-Target Pair
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