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Compile Data Set for Download or QSAR

Found 143 hits with Last Name = 'yoshimura' and Initial = 'n'   
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
Nicotinamide N-methyltransferase


(Mus musculus)
BDBM50566781
PNG
(CHEMBL4867273)
Show SMILES CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(cc2)-c2ccc(cc2)C(N)=O)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCN)NC1=O)C(N)=O |r|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 0.150n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of mouse recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Homo sapiens (Human))
BDBM50566781
PNG
(CHEMBL4867273)
Show SMILES CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(cc2)-c2ccc(cc2)C(N)=O)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCN)NC1=O)C(N)=O |r|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 0.150n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Homo sapiens (Human))
BDBM50566783
PNG
(CHEMBL4859806)
Show SMILES CN(C)CCCC[C@@H]1NC(=O)[C@H](CC(C)(C)C)NC(=O)[C@@H]2C[C@H](CN2C(=O)[C@H](Cc2ccccc2)N(C)C(=O)CSCCNC(=O)[C@H](Cc2ccc(cc2)-c2ccc(cc2)C(N)=O)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H]2CC(F)(F)CN2C1=O)c1ccccc1 |r|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 0.400n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Homo sapiens (Human))
BDBM50566776
PNG
(CHEMBL4847740)
Show SMILES CC(C)C[C@@H]1NC(=O)[C@@H]2C[C@H](CN2C(=O)[C@H](Cc2ccccc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(cc2)C(N)=O)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCN)NC1=O)C(N)=O)c1ccccc1 |r|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 0.470n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Mus musculus)
BDBM50566783
PNG
(CHEMBL4859806)
Show SMILES CN(C)CCCC[C@@H]1NC(=O)[C@H](CC(C)(C)C)NC(=O)[C@@H]2C[C@H](CN2C(=O)[C@H](Cc2ccccc2)N(C)C(=O)CSCCNC(=O)[C@H](Cc2ccc(cc2)-c2ccc(cc2)C(N)=O)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H]2CC(F)(F)CN2C1=O)c1ccccc1 |r|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 0.620n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of mouse recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Homo sapiens (Human))
BDBM50566782
PNG
(CHEMBL4857394)
Show SMILES CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(cc2)-c2cccc(c2)C(N)=O)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCN)NC1=O)C(N)=O |r|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 0.930n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Mus musculus)
BDBM50566782
PNG
(CHEMBL4857394)
Show SMILES CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(cc2)-c2cccc(c2)C(N)=O)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCN)NC1=O)C(N)=O |r|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 0.950n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of mouse recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Homo sapiens (Human))
BDBM50598881
PNG
(CHEMBL5194905)
Show SMILES Cc1cc(CN)n(n1)[C@H]1C[C@@H](N(C1)C(=O)c1cnc2[nH]c(C)cc2c1)c1cc2cc(C)ccc2n1Cc1ccc(Cl)cc1 |r|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

MCE
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.10n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00919
BindingDB Entry DOI: 10.7270/Q2KS6WJ1
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Homo sapiens (Human))
BDBM50566772
PNG
(CHEMBL4878738)
Show SMILES CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)N(C)C(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(cc2)C(N)=O)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCCN)NC1=O)C(N)=O |r|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.10n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Mus musculus)
BDBM50566776
PNG
(CHEMBL4847740)
Show SMILES CC(C)C[C@@H]1NC(=O)[C@@H]2C[C@H](CN2C(=O)[C@H](Cc2ccccc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(cc2)C(N)=O)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCN)NC1=O)C(N)=O)c1ccccc1 |r|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.20n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of mouse recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Mus musculus)
BDBM50566772
PNG
(CHEMBL4878738)
Show SMILES CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)N(C)C(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(cc2)C(N)=O)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCCN)NC1=O)C(N)=O |r|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.30n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of mouse recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Homo sapiens (Human))
BDBM50566784
PNG
(CHEMBL4872872)
Show SMILES CN1[C@@H](Cc2ccccc2)C(=O)N2C[C@@H](C[C@H]2C(=O)N[C@@H](CC(C)(C)C)C(=O)N2CCCC[C@H]2C(=O)N2CC(F)(F)C[C@H]2C(=O)N2Cc3ccccc3C[C@H]2C(=O)N[C@@H](Cc2ccc(cc2)-c2ccc(cc2)C(N)=O)C(=O)NCCSCC1=O)c1ccccc1 |r|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.90n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Mus musculus)
BDBM50566784
PNG
(CHEMBL4872872)
Show SMILES CN1[C@@H](Cc2ccccc2)C(=O)N2C[C@@H](C[C@H]2C(=O)N[C@@H](CC(C)(C)C)C(=O)N2CCCC[C@H]2C(=O)N2CC(F)(F)C[C@H]2C(=O)N2Cc3ccccc3C[C@H]2C(=O)N[C@@H](Cc2ccc(cc2)-c2ccc(cc2)C(N)=O)C(=O)NCCSCC1=O)c1ccccc1 |r|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of mouse recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Homo sapiens (Human))
BDBM50566775
PNG
(CHEMBL4856854)
Show SMILES CC(C)C[C@@H]1NC(=O)[C@@H]2C[C@H](CN2C(=O)[C@H](Cc2ccccc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(cc2)C(N)=O)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCN)NC1=O)C(N)=O)C(F)(F)F |r|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 5.80n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Homo sapiens (Human))
BDBM50566786
PNG
(CHEMBL4866114)
Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CSC[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O)C(=O)NCC(N)=O |r|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 12n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Mus musculus)
BDBM50566777
PNG
(CHEMBL4848464)
Show SMILES CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(cc2)C(N)=O)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H]2CC(F)(F)CN2C(=O)[C@H](CCCCN)NC1=O)C(N)=O |r|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 13n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of mouse recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Homo sapiens (Human))
BDBM50566773
PNG
(CHEMBL4853328)
Show SMILES CC(C)C[C@@H]1NC(=O)[C@@H]2CC(F)(F)CN2C(=O)[C@H](Cc2ccccc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(cc2)C(N)=O)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCN)NC1=O)C(N)=O |r|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 14n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Homo sapiens (Human))
BDBM50566777
PNG
(CHEMBL4848464)
Show SMILES CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(cc2)C(N)=O)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H]2CC(F)(F)CN2C(=O)[C@H](CCCCN)NC1=O)C(N)=O |r|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 14n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Homo sapiens (Human))
BDBM50598880
PNG
(CHEMBL5187248)
Show SMILES Cc1ccc2n(Cc3ccc(Cl)cc3)c(cc2c1)[C@H]1C[C@@H](CN1C(=O)c1cnc2[nH]ccc2c1)n1ccnc1CN |r|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem
PDB
Article
PubMed
n/an/a 16n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00919
BindingDB Entry DOI: 10.7270/Q2KS6WJ1
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Nicotinamide N-methyltransferase


(Mus musculus)
BDBM50566775
PNG
(CHEMBL4856854)
Show SMILES CC(C)C[C@@H]1NC(=O)[C@@H]2C[C@H](CN2C(=O)[C@H](Cc2ccccc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(cc2)C(N)=O)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCN)NC1=O)C(N)=O)C(F)(F)F |r|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 18n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of mouse recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Mus musculus)
BDBM50566773
PNG
(CHEMBL4853328)
Show SMILES CC(C)C[C@@H]1NC(=O)[C@@H]2CC(F)(F)CN2C(=O)[C@H](Cc2ccccc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(cc2)C(N)=O)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCN)NC1=O)C(N)=O |r|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 18n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of mouse recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Mus musculus)
BDBM50566771
PNG
(CHEMBL4859039)
Show SMILES CN1[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC(C)(C)C)C(=O)N[C@@H](CCCCN)C(=O)N2CCC[C@H]2C(=O)N2Cc3ccccc3C[C@H]2C(=O)N[C@@H](Cc2ccc(cc2)C(N)=O)C(=O)N[C@@H](CSCC1=O)C(N)=O |r|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 23n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of mouse recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Mus musculus)
BDBM50566759
PNG
(CHEMBL4868588)
Show SMILES NC(=N)NCCC[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(cc2)C(N)=O)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H]2CCCN2C1=O)C(N)=O |r|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 25n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of mouse recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Homo sapiens (Human))
BDBM50566759
PNG
(CHEMBL4868588)
Show SMILES NC(=N)NCCC[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(cc2)C(N)=O)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H]2CCCN2C1=O)C(N)=O |r|
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TBA

Assay Description
Inhibition of human recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Homo sapiens (Human))
BDBM50566771
PNG
(CHEMBL4859039)
Show SMILES CN1[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC(C)(C)C)C(=O)N[C@@H](CCCCN)C(=O)N2CCC[C@H]2C(=O)N2Cc3ccccc3C[C@H]2C(=O)N[C@@H](Cc2ccc(cc2)C(N)=O)C(=O)N[C@@H](CSCC1=O)C(N)=O |r|
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TBA

Assay Description
Inhibition of human recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Mus musculus)
BDBM50566785
PNG
(CHEMBL4868364)
Show SMILES CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(cc2)C(N)=O)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCN)NC1=O)C(N)=O |r|
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Assay Description
Inhibition of mouse recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Homo sapiens (Human))
BDBM50566765
PNG
(CHEMBL4849636)
Show SMILES CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)N(C)C(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(cc2)C(N)=O)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O |r|
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TBA

Assay Description
Inhibition of human recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Homo sapiens (Human))
BDBM50566774
PNG
(CHEMBL4858283)
Show SMILES CC(C)C[C@@H]1NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@H](Cc2ccccc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(cc2)C(N)=O)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCN)NC1=O)C(N)=O)C(F)(F)F |r|
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TBA

Assay Description
Inhibition of human recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Homo sapiens (Human))
BDBM50566785
PNG
(CHEMBL4868364)
Show SMILES CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(cc2)C(N)=O)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCN)NC1=O)C(N)=O |r|
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Assay Description
Inhibition of human recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Mus musculus)
BDBM50566770
PNG
(CHEMBL4863816)
Show SMILES CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)N(C)C(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(cc2)C(N)=O)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCN)NC1=O)C(N)=O |r|
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Assay Description
Inhibition of mouse recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Homo sapiens (Human))
BDBM50566770
PNG
(CHEMBL4863816)
Show SMILES CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)N(C)C(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(cc2)C(N)=O)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCN)NC1=O)C(N)=O |r|
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TBA

Assay Description
Inhibition of human recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Mus musculus)
BDBM50566780
PNG
(CHEMBL4860372)
Show SMILES CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(cc2)-c2ccccc2)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCN)NC1=O)C(N)=O |r|
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Assay Description
Inhibition of mouse recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Mus musculus)
BDBM50566765
PNG
(CHEMBL4849636)
Show SMILES CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)N(C)C(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(cc2)C(N)=O)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CCCNC(N)=N)NC1=O)C(N)=O |r|
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Assay Description
Inhibition of mouse recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Homo sapiens (Human))
BDBM50598882
PNG
(CHEMBL5178360)
Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1c[nH]c3ccccc13)NC(=O)CN(CCCCCC)C(=O)CNC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccc(cc1)C(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CSC[C@H](NC2=O)C(N)=O |r|
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00919
BindingDB Entry DOI: 10.7270/Q2KS6WJ1
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Homo sapiens (Human))
BDBM50598878
PNG
(CHEMBL5174146)
Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1c[nH]c3ccccc13)NC(=O)CN(CCCCCC)C(=O)CNC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccc(cc1)C(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CSC[C@H](NC2=O)C(=O)NCC(N)=O |r|
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00919
BindingDB Entry DOI: 10.7270/Q2KS6WJ1
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Homo sapiens (Human))
BDBM50566766
PNG
(CHEMBL4875414)
Show SMILES CN1[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](CCCCN)C(=O)N2CCC[C@H]2C(=O)N2Cc3ccccc3C[C@H]2C(=O)N[C@@H](Cc2ccc(cc2)C(N)=O)C(=O)N[C@@H](CSCC1=O)C(N)=O |r|
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TBA

Assay Description
Inhibition of human recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Transitional endoplasmic reticulum ATPase


(Mus musculus (Mouse))
BDBM194635
PNG
(US9206129, 51)
Show SMILES Cc1cccc(C)c1-c1ccc(cn1)\N=N\c1cc(c2ccccc2c1N)S(=O)(=O)O[Na]
Show InChI InChI=1S/C23H20N4O3S.Na/c1-14-6-5-7-15(2)22(14)19-11-10-16(13-25-19)26-27-20-12-21(31(28,29)30)17-8-3-4-9-18(17)23(20)24;/h3-13H,24H2,1-2H3,(H,28,29,30);/q;+1/p-1/b27-26+;
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n/an/a 112n/an/an/an/a8.037



Daito Chemix Corporation; Kyoto University

US Patent


Assay Description
Mouse VCP cDNA was added with a DNA sequence corresponding to histidine tag at the amino-terminal, subcloned into a baculovirus vector pVL1392 (BD Bi...


US Patent US9206129 (2015)


BindingDB Entry DOI: 10.7270/Q29P30GQ
More data for this
Ligand-Target Pair
Transitional endoplasmic reticulum ATPase


(Mus musculus (Mouse))
BDBM194589
PNG
(US9206129, 5)
Show SMILES Nc1c(cc(c2ccccc12)S(=O)(=O)O[Na])\N=N\c1ccc(nc1)-c1ccccc1-c1ccccc1
Show InChI InChI=1S/C27H20N4O3S.Na/c28-27-23-13-7-6-12-22(23)26(35(32,33)34)16-25(27)31-30-19-14-15-24(29-17-19)21-11-5-4-10-20(21)18-8-2-1-3-9-18;/h1-17H,28H2,(H,32,33,34);/q;+1/p-1/b31-30+;
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Daito Chemix Corporation; Kyoto University

US Patent


Assay Description
Mouse VCP cDNA was added with a DNA sequence corresponding to histidine tag at the amino-terminal, subcloned into a baculovirus vector pVL1392 (BD Bi...


US Patent US9206129 (2015)


BindingDB Entry DOI: 10.7270/Q29P30GQ
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Homo sapiens (Human))
BDBM50566760
PNG
(CHEMBL4870987)
Show SMILES CN1[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N2CCC[C@H]2C(=O)N2Cc3ccccc3C[C@H]2C(=O)N[C@@H](Cc2ccc(cc2)C(N)=O)C(=O)N[C@@H](CSCC1=O)C(N)=O |r|
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Assay Description
Inhibition of human recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Transitional endoplasmic reticulum ATPase


(Mus musculus (Mouse))
BDBM194615
PNG
(US9206129, 31)
Show SMILES CCCOc1ccccc1-c1ccc(cn1)\N=N\c1cc(c2ccccc2c1N)S(=O)(=O)O[Na]
Show InChI InChI=1S/C24H22N4O4S.Na/c1-2-13-32-22-10-6-5-9-19(22)20-12-11-16(15-26-20)27-28-21-14-23(33(29,30)31)17-7-3-4-8-18(17)24(21)25;/h3-12,14-15H,2,13,25H2,1H3,(H,29,30,31);/q;+1/p-1/b28-27+;
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Daito Chemix Corporation; Kyoto University

US Patent


Assay Description
Mouse VCP cDNA was added with a DNA sequence corresponding to histidine tag at the amino-terminal, subcloned into a baculovirus vector pVL1392 (BD Bi...


US Patent US9206129 (2015)


BindingDB Entry DOI: 10.7270/Q29P30GQ
More data for this
Ligand-Target Pair
Transitional endoplasmic reticulum ATPase


(Mus musculus (Mouse))
BDBM194629
PNG
(US9206129, 45)
Show SMILES CC(C)COc1ccccc1-c1ccc(cn1)\N=N\c1cc(c2ccccc2c1N)S(=O)(=O)O[Na]
Show InChI InChI=1S/C25H24N4O4S.Na/c1-16(2)15-33-23-10-6-5-9-20(23)21-12-11-17(14-27-21)28-29-22-13-24(34(30,31)32)18-7-3-4-8-19(18)25(22)26;/h3-14,16H,15,26H2,1-2H3,(H,30,31,32);/q;+1/p-1/b29-28+;
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Daito Chemix Corporation; Kyoto University

US Patent


Assay Description
Mouse VCP cDNA was added with a DNA sequence corresponding to histidine tag at the amino-terminal, subcloned into a baculovirus vector pVL1392 (BD Bi...


US Patent US9206129 (2015)


BindingDB Entry DOI: 10.7270/Q29P30GQ
More data for this
Ligand-Target Pair
Transitional endoplasmic reticulum ATPase


(Mus musculus (Mouse))
BDBM194592
PNG
(US9206129, 8)
Show SMILES CC(=O)c1ccc(cc1)-c1ccc(cn1)\N=N\c1cc(c2ccccc2c1N)S(=O)(=O)O[Na]
Show InChI InChI=1S/C23H18N4O4S.Na/c1-14(28)15-6-8-16(9-7-15)20-11-10-17(13-25-20)26-27-21-12-22(32(29,30)31)18-4-2-3-5-19(18)23(21)24;/h2-13H,24H2,1H3,(H,29,30,31);/q;+1/p-1/b27-26+;
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Daito Chemix Corporation; Kyoto University

US Patent


Assay Description
Mouse VCP cDNA was added with a DNA sequence corresponding to histidine tag at the amino-terminal, subcloned into a baculovirus vector pVL1392 (BD Bi...


US Patent US9206129 (2015)


BindingDB Entry DOI: 10.7270/Q29P30GQ
More data for this
Ligand-Target Pair
Transitional endoplasmic reticulum ATPase


(Mus musculus (Mouse))
BDBM194617
PNG
(US9206129, 33)
Show SMILES CCCOc1ccc(F)cc1-c1ccc(cn1)\N=N\c1cc(c2ccccc2c1N)S(=O)(=O)O[Na]
Show InChI InChI=1S/C24H21FN4O4S.Na/c1-2-11-33-22-10-7-15(25)12-19(22)20-9-8-16(14-27-20)28-29-21-13-23(34(30,31)32)17-5-3-4-6-18(17)24(21)26;/h3-10,12-14H,2,11,26H2,1H3,(H,30,31,32);/q;+1/p-1/b29-28+;
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Daito Chemix Corporation; Kyoto University

US Patent


Assay Description
Mouse VCP cDNA was added with a DNA sequence corresponding to histidine tag at the amino-terminal, subcloned into a baculovirus vector pVL1392 (BD Bi...


US Patent US9206129 (2015)


BindingDB Entry DOI: 10.7270/Q29P30GQ
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Homo sapiens (Human))
BDBM50566780
PNG
(CHEMBL4860372)
Show SMILES CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CSC[C@H](NC(=O)[C@H](Cc2ccc(cc2)-c2ccccc2)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CCCCN)NC1=O)C(N)=O |r|
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Assay Description
Inhibition of human recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Transitional endoplasmic reticulum ATPase


(Mus musculus (Mouse))
BDBM194601
PNG
(US9206129, 17)
Show SMILES CC(C)Oc1ccccc1-c1ccc(cn1)\N=N\c1cc(c2ccccc2c1N)S(=O)(=O)O[Na]
Show InChI InChI=1S/C24H22N4O4S.Na/c1-15(2)32-22-10-6-5-9-19(22)20-12-11-16(14-26-20)27-28-21-13-23(33(29,30)31)17-7-3-4-8-18(17)24(21)25;/h3-15H,25H2,1-2H3,(H,29,30,31);/q;+1/p-1/b28-27+;
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Daito Chemix Corporation; Kyoto University

US Patent


Assay Description
Mouse VCP cDNA was added with a DNA sequence corresponding to histidine tag at the amino-terminal, subcloned into a baculovirus vector pVL1392 (BD Bi...


US Patent US9206129 (2015)


BindingDB Entry DOI: 10.7270/Q29P30GQ
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Homo sapiens (Human))
BDBM50566764
PNG
(CHEMBL4873940)
Show SMILES CN1[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N2CCC[C@H]2C(=O)N2Cc3ccccc3C[C@H]2C(=O)N[C@@H](Cc2ccc(cc2)C(N)=O)C(=O)N[C@@H](CSCC1=O)C(N)=O |r|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 145n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human recombinant NNMT using nicotinamide and SAM as substrate assessed as reduction in 1-methyl-nicotinamide formation incubated for 2...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00134
BindingDB Entry DOI: 10.7270/Q21J9FJD
More data for this
Ligand-Target Pair
Transitional endoplasmic reticulum ATPase


(Mus musculus (Mouse))
BDBM194588
PNG
(US9206129, 4)
Show SMILES Cc1ccccc1-c1ccc(cn1)\N=N\c1cc(c2ccccc2c1N)S(=O)(=O)O[Na]
Show InChI InChI=1S/C22H18N4O3S.Na/c1-14-6-2-3-7-16(14)19-11-10-15(13-24-19)25-26-20-12-21(30(27,28)29)17-8-4-5-9-18(17)22(20)23;/h2-13H,23H2,1H3,(H,27,28,29);/q;+1/p-1/b26-25+;
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 149n/an/an/an/a8.037



Daito Chemix Corporation; Kyoto University

US Patent


Assay Description
Mouse VCP cDNA was added with a DNA sequence corresponding to histidine tag at the amino-terminal, subcloned into a baculovirus vector pVL1392 (BD Bi...


US Patent US9206129 (2015)


BindingDB Entry DOI: 10.7270/Q29P30GQ
More data for this
Ligand-Target Pair
Nicotinamide N-methyltransferase


(Homo sapiens (Human))
BDBM50598884
PNG
(CHEMBL5191549)
Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1c[nH]c3ccccc13)NC(=O)CN(CCCCCC)C(=O)CNC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CSC[C@H](NC2=O)C(N)=O |r|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 160n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00919
BindingDB Entry DOI: 10.7270/Q2KS6WJ1
More data for this
Ligand-Target Pair
Transitional endoplasmic reticulum ATPase


(Mus musculus (Mouse))
BDBM194637
PNG
(US9206129, 53)
Show SMILES CCCCOc1c(C=O)cc(C)cc1-c1ccc(cn1)\N=N\c1cc(c2ccccc2c1N)S(=O)(=O)O[Na]
Show InChI InChI=1S/C27H26N4O5S.Na/c1-3-4-11-36-27-18(16-32)12-17(2)13-22(27)23-10-9-19(15-29-23)30-31-24-14-25(37(33,34)35)20-7-5-6-8-21(20)26(24)28;/h5-10,12-16H,3-4,11,28H2,1-2H3,(H,33,34,35);/q;+1/p-1/b31-30+;
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 161n/an/an/an/a8.037



Daito Chemix Corporation; Kyoto University

US Patent


Assay Description
Mouse VCP cDNA was added with a DNA sequence corresponding to histidine tag at the amino-terminal, subcloned into a baculovirus vector pVL1392 (BD Bi...


US Patent US9206129 (2015)


BindingDB Entry DOI: 10.7270/Q29P30GQ
More data for this
Ligand-Target Pair
Transitional endoplasmic reticulum ATPase


(Mus musculus (Mouse))
BDBM194594
PNG
(US9206129, 10)
Show SMILES Nc1c(cc(c2ccccc12)S(=O)(=O)O[Na])\N=N\c1ccc(nc1)-c1ccccc1C(F)(F)F
Show InChI InChI=1S/C22H15F3N4O3S.Na/c23-22(24,25)17-8-4-3-7-16(17)18-10-9-13(12-27-18)28-29-19-11-20(33(30,31)32)14-5-1-2-6-15(14)21(19)26;/h1-12H,26H2,(H,30,31,32);/q;+1/p-1/b29-28+;
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 170n/an/an/an/a8.037



Daito Chemix Corporation; Kyoto University

US Patent


Assay Description
Mouse VCP cDNA was added with a DNA sequence corresponding to histidine tag at the amino-terminal, subcloned into a baculovirus vector pVL1392 (BD Bi...


US Patent US9206129 (2015)


BindingDB Entry DOI: 10.7270/Q29P30GQ
More data for this
Ligand-Target Pair
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