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Compile Data Set for Download or QSAR

Found 22 hits Enz. Inhib. hit(s) with Target = 'Melanoma-associated antigen 4'   
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
Melanoma-associated antigen 4


(Homo sapiens)
BDBM50605667
PNG
(CHEMBL5187815)
Show SMILES [H][C@]1(NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CS)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O)C(N)=O)[C@@H](C)O |r|
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n/an/a<1n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00185
BindingDB Entry DOI: 10.7270/Q2V128WF
More data for this
Ligand-Target Pair
Melanoma-associated antigen 4


(Homo sapiens)
BDBM50605668
PNG
(CHEMBL5199001)
Show SMILES [H][C@]1(NC(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@]([H])(NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@]([H])(NC(=O)[C@@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC1=O)C(N)=O)C(C)C)[C@H](C)O)[C@@H](C)O)[C@@H](C)O |r|
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n/an/a 1.30n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00185
BindingDB Entry DOI: 10.7270/Q2V128WF
More data for this
Ligand-Target Pair
Melanoma-associated antigen 4


(Homo sapiens)
BDBM50605666
PNG
(CHEMBL5188210)
Show SMILES [H][C@]1(NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O)[C@@H](C)CC |r|
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n/an/a 2.20n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00185
BindingDB Entry DOI: 10.7270/Q2V128WF
More data for this
Ligand-Target Pair
Melanoma-associated antigen 4


(Homo sapiens)
BDBM50605669
PNG
(CHEMBL5208958)
Show SMILES [H][C@]1(NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O)[C@@H](C)CC |r|
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00185
BindingDB Entry DOI: 10.7270/Q2V128WF
More data for this
Ligand-Target Pair
Melanoma-associated antigen 4


(Homo sapiens)
BDBM50605670
PNG
(CHEMBL5182108)
Show SMILES [H][C@]1(NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O)[C@@H](C)CC |r|
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00185
BindingDB Entry DOI: 10.7270/Q2V128WF
More data for this
Ligand-Target Pair
Melanoma-associated antigen 4


(Homo sapiens)
BDBM50605672
PNG
(CHEMBL5197762)
Show SMILES [H][C@]1(NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O)[C@@H](C)CC |r|
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00185
BindingDB Entry DOI: 10.7270/Q2V128WF
More data for this
Ligand-Target Pair
Melanoma-associated antigen 4


(Homo sapiens)
BDBM50605674
PNG
(CHEMBL5187977)
Show SMILES [H][C@]1(NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC1=O)C(N)=O)[C@@H](C)CC |r|
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00185
BindingDB Entry DOI: 10.7270/Q2V128WF
More data for this
Ligand-Target Pair
Melanoma-associated antigen 4


(Homo sapiens)
BDBM50605677
PNG
(CHEMBL5175619)
Show SMILES [H][C@]1(NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O)[C@@H](C)CC |r|
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00185
BindingDB Entry DOI: 10.7270/Q2V128WF
More data for this
Ligand-Target Pair
Melanoma-associated antigen 4


(Homo sapiens)
BDBM50605678
PNG
(CHEMBL5197324)
Show SMILES [H][C@]1(NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)CNC(=O)CNC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O)[C@@H](C)CC |r|
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00185
BindingDB Entry DOI: 10.7270/Q2V128WF
More data for this
Ligand-Target Pair
Melanoma-associated antigen 4


(Homo sapiens)
BDBM50605671
PNG
(CHEMBL5189065)
Show SMILES [H][C@]1(NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O)[C@@H](C)CC |r|
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00185
BindingDB Entry DOI: 10.7270/Q2V128WF
More data for this
Ligand-Target Pair
Melanoma-associated antigen 4


(Homo sapiens)
BDBM50605676
PNG
(CHEMBL5174657)
Show SMILES [H][C@]1(NC(=O)[C@H](C)NC(=O)CSC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O)[C@@H](C)CC |r|
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00185
BindingDB Entry DOI: 10.7270/Q2V128WF
More data for this
Ligand-Target Pair
Melanoma-associated antigen 4


(Homo sapiens)
BDBM50605673
PNG
(CHEMBL5188864)
Show SMILES [H][C@]1(NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O)[C@@H](C)CC |r|
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00185
BindingDB Entry DOI: 10.7270/Q2V128WF
More data for this
Ligand-Target Pair
Melanoma-associated antigen 4


(Homo sapiens)
BDBM50605679
PNG
(CHEMBL5175748)
Show SMILES [H][C@]1(NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)CNC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O)[C@@H](C)CC |r|
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00185
BindingDB Entry DOI: 10.7270/Q2V128WF
More data for this
Ligand-Target Pair
Melanoma-associated antigen 4


(Homo sapiens)
BDBM50605675
PNG
(CHEMBL5202217)
Show SMILES CC(C)C[C@@H]1NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](C)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O)C(N)=O |r|
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n/an/a 6.18E+3n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00185
BindingDB Entry DOI: 10.7270/Q2V128WF
More data for this
Ligand-Target Pair
Melanoma-associated antigen 4


(Homo sapiens)
BDBM50605680
PNG
(CHEMBL5174081)
Show SMILES [H][C@]1(NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O)[C@@H](C)CC |r|
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00185
BindingDB Entry DOI: 10.7270/Q2V128WF
More data for this
Ligand-Target Pair
Melanoma-associated antigen 4


(Homo sapiens)
BDBM50605681
PNG
(CHEMBL5208599)
Show SMILES [H][C@](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)([C@@H](C)CC)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(N)=O |r|
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00185
BindingDB Entry DOI: 10.7270/Q2V128WF
More data for this
Ligand-Target Pair
Melanoma-associated antigen 4


(Homo sapiens)
BDBM50605666
PNG
(CHEMBL5188210)
Show SMILES [H][C@]1(NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O)[C@@H](C)CC |r|
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00185
BindingDB Entry DOI: 10.7270/Q2V128WF
More data for this
Ligand-Target Pair
Melanoma-associated antigen 4


(Homo sapiens)
BDBM50605668
PNG
(CHEMBL5199001)
Show SMILES [H][C@]1(NC(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@]([H])(NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@]([H])(NC(=O)[C@@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC1=O)C(N)=O)C(C)C)[C@H](C)O)[C@@H](C)O)[C@@H](C)O |r|
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00185
BindingDB Entry DOI: 10.7270/Q2V128WF
More data for this
Ligand-Target Pair
Melanoma-associated antigen 4


(Homo sapiens)
BDBM50605667
PNG
(CHEMBL5187815)
Show SMILES [H][C@]1(NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CS)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O)C(N)=O)[C@@H](C)O |r|
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00185
BindingDB Entry DOI: 10.7270/Q2V128WF
More data for this
Ligand-Target Pair
Melanoma-associated antigen 4


(Homo sapiens)
BDBM50605666
PNG
(CHEMBL5188210)
Show SMILES [H][C@]1(NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O)[C@@H](C)CC |r|
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00185
BindingDB Entry DOI: 10.7270/Q2V128WF
More data for this
Ligand-Target Pair
Melanoma-associated antigen 4


(Homo sapiens)
BDBM50605667
PNG
(CHEMBL5187815)
Show SMILES [H][C@]1(NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H]2CCCN2C(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CS)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC1=O)C(N)=O)[C@@H](C)O |r|
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Article
PubMed
n/an/an/a 6.5n/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00185
BindingDB Entry DOI: 10.7270/Q2V128WF
More data for this
Ligand-Target Pair
Melanoma-associated antigen 4


(Homo sapiens)
BDBM50605668
PNG
(CHEMBL5199001)
Show SMILES [H][C@]1(NC(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@]([H])(NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@]([H])(NC(=O)[C@@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CSC[C@H](NC1=O)C(N)=O)C(C)C)[C@H](C)O)[C@@H](C)O)[C@@H](C)O |r|
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 47n/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00185
BindingDB Entry DOI: 10.7270/Q2V128WF
More data for this
Ligand-Target Pair