Found 63 hits with Last Name = 'fleischer' and Initial = 'tc' Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM81396
(GMX1778)Show SMILES Clc1ccc(OCCCCCCNC(NC#N)=Nc2ccncc2)cc1 |w:17.17| Show InChI InChI=1S/C19H22ClN5O/c20-16-5-7-18(8-6-16)26-14-4-2-1-3-11-23-19(24-15-21)25-17-9-12-22-13-10-17/h5-10,12-13H,1-4,11,14H2,(H2,22,23,24,25) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| Purchase
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 0.0700 | n/a | n/a | n/a | n/a | n/a | n/a |
Myriad Pharmaceuticals
| Assay Description
In vitro inhibition assay using human nampt, NMN adenylytransferase (nmant1)and UDP-glucose dehdryogenase (ugdh) genes. |
Chem Biol 17: 659-64 (2010)
Article DOI: 10.1016/j.chembiol.2010.05.008
BindingDB Entry DOI: 10.7270/Q2VT1QJW |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM81395
(APO-866)Show SMILES O=C(NCCCCC1CCN(CC1)C(=O)c1ccccc1)\C=C\c1cccnc1 Show InChI InChI=1S/C24H29N3O2/c28-23(12-11-21-8-6-15-25-19-21)26-16-5-4-7-20-13-17-27(18-14-20)24(29)22-9-2-1-3-10-22/h1-3,6,8-12,15,19-20H,4-5,7,13-14,16-18H2,(H,26,28)/b12-11+ | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
MCE
MMDB
PC cid
PC sid
PDB
UniChem
Patents
| MMDB
PDB
Article
PubMed
| n/a | n/a | 0.140 | n/a | n/a | n/a | n/a | n/a | n/a |
Myriad Pharmaceuticals
| Assay Description
In vitro inhibition assay using human nampt, NMN adenylytransferase (nmant1)and UDP-glucose dehdryogenase (ugdh) genes. |
Chem Biol 17: 659-64 (2010)
Article DOI: 10.1016/j.chembiol.2010.05.008
BindingDB Entry DOI: 10.7270/Q2VT1QJW |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM81393
(MPI-0479883)Show SMILES Cn1c(CN2CCN(CCN)CC2)nc2cc(Cl)c(CN(CC#C)c3ccc(cc3)C(=O)NCc3cccnc3)cc2c1=O Show InChI InChI=1S/C33H37ClN8O2/c1-3-12-42(27-8-6-25(7-9-27)32(43)37-21-24-5-4-11-36-20-24)22-26-18-28-30(19-29(26)34)38-31(39(2)33(28)44)23-41-16-14-40(13-10-35)15-17-41/h1,4-9,11,18-20H,10,12-17,21-23,35H2,2H3,(H,37,43) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.170 | n/a | n/a | n/a | n/a | n/a | n/a |
Myriad Pharmaceuticals
| Assay Description
In vitro inhibition assay using human nampt, NMN adenylytransferase (nmant1)and UDP-glucose dehdryogenase (ugdh) genes. |
Chem Biol 17: 659-64 (2010)
Article DOI: 10.1016/j.chembiol.2010.05.008
BindingDB Entry DOI: 10.7270/Q2VT1QJW |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50117198
(4-{[7-Chloro-3-methyl-2-(4-methyl-piperazin-1-ylme...)Show SMILES CN1CCN(Cc2nc3cc(Cl)c(CN(CC#C)c4ccc(cc4)C(=O)NCc4cccnc4)cc3c(=O)n2C)CC1 Show InChI InChI=1S/C32H34ClN7O2/c1-4-12-40(26-9-7-24(8-10-26)31(41)35-20-23-6-5-11-34-19-23)21-25-17-27-29(18-28(25)33)36-30(38(3)32(27)42)22-39-15-13-37(2)14-16-39/h1,5-11,17-19H,12-16,20-22H2,2-3H3,(H,35,41) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 0.230 | n/a | n/a | n/a | n/a | n/a | n/a |
Myriad Pharmaceuticals
| Assay Description
In vitro inhibition assay using human nampt, NMN adenylytransferase (nmant1)and UDP-glucose dehdryogenase (ugdh) genes. |
Chem Biol 17: 659-64 (2010)
Article DOI: 10.1016/j.chembiol.2010.05.008
BindingDB Entry DOI: 10.7270/Q2VT1QJW |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347432
(CHEMBL1801863)Show SMILES Cn1c(CN2CCN(CCCN)CC2)nc2cc(Cl)c(CN(CC#C)c3ccc(cc3)C(=O)NCc3cccnc3)cc2c1=O Show InChI InChI=1S/C34H39ClN8O2/c1-3-13-43(28-9-7-26(8-10-28)33(44)38-22-25-6-4-12-37-21-25)23-27-19-29-31(20-30(27)35)39-32(40(2)34(29)45)24-42-17-15-41(16-18-42)14-5-11-36/h1,4,6-10,12,19-21H,5,11,13-18,22-24,36H2,2H3,(H,38,44) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.300 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50117198
(4-{[7-Chloro-3-methyl-2-(4-methyl-piperazin-1-ylme...)Show SMILES CN1CCN(Cc2nc3cc(Cl)c(CN(CC#C)c4ccc(cc4)C(=O)NCc4cccnc4)cc3c(=O)n2C)CC1 Show InChI InChI=1S/C32H34ClN7O2/c1-4-12-40(26-9-7-24(8-10-26)31(41)35-20-23-6-5-11-34-19-23)21-25-17-27-29(18-28(25)33)36-30(38(3)32(27)42)22-39-15-13-37(2)14-16-39/h1,5-11,17-19H,12-16,20-22H2,2-3H3,(H,35,41) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 0.310 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347433
(CHEMBL1801864)Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#7](-[#6]-c1cc2c(cc1Cl)nnn(-[#6])c2=O)-c1ccc(cc1)-[#6](=O)-[#7]-[#6]-c1cccnc1 Show InChI InChI=1S/C27H27ClN6O2/c1-18(2)10-12-34(17-21-13-23-25(14-24(21)28)31-32-33(3)27(23)36)22-8-6-20(7-9-22)26(35)30-16-19-5-4-11-29-15-19/h4-11,13-15H,12,16-17H2,1-3H3,(H,30,35) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 0.450 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347427
(CHEMBL1801934)Show SMILES Cc1nc2cc(Cl)c(CN(CC#C)c3ccc(cc3)C(=O)NCc3cccnc3)cc2c(=O)n1C Show InChI InChI=1S/C27H24ClN5O2/c1-4-12-33(17-21-13-23-25(14-24(21)28)31-18(2)32(3)27(23)35)22-9-7-20(8-10-22)26(34)30-16-19-6-5-11-29-15-19/h1,5-11,13-15H,12,16-17H2,2-3H3,(H,30,34) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.550 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347431
(CHEMBL1801862)Show SMILES Cn1c(CO)nc2cc(Cl)c(CN(CC#C)c3ccc(cc3)C(=O)NCc3cccnc3)cc2c1=O Show InChI InChI=1S/C27H24ClN5O3/c1-3-11-33(16-20-12-22-24(13-23(20)28)31-25(17-34)32(2)27(22)36)21-8-6-19(7-9-21)26(35)30-15-18-5-4-10-29-14-18/h1,4-10,12-14,34H,11,15-17H2,2H3,(H,30,35) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.790 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347394
(CHEMBL1801566)Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#7](-[#6]-c1ccc2ncn(-[#6])c(=O)c2c1)-c1ccc(cc1)-[#6](=O)-[#7]-[#6]-c1cccnc1 Show InChI InChI=1S/C28H29N5O2/c1-20(2)12-14-33(18-21-6-11-26-25(15-21)28(35)32(3)19-31-26)24-9-7-23(8-10-24)27(34)30-17-22-5-4-13-29-16-22/h4-13,15-16,19H,14,17-18H2,1-3H3,(H,30,34) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347407
(CHEMBL1801561)Show SMILES Clc1ccccc1CN(CC1CC1)c1ccc(cc1)C(=O)NCc1cccnc1 Show InChI InChI=1S/C24H24ClN3O/c25-23-6-2-1-5-21(23)17-28(16-18-7-8-18)22-11-9-20(10-12-22)24(29)27-15-19-4-3-13-26-14-19/h1-6,9-14,18H,7-8,15-17H2,(H,27,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347415
(CHEMBL1801552)Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#7](-[#6]-c1ccc2nc(-[#6])n(-[#6])c(=O)c2c1)-c1ccc(cc1)-[#6](=O)-[#7]-[#6]-c1cccnc1 Show InChI InChI=1S/C29H31N5O2/c1-20(2)13-15-34(19-22-7-12-27-26(16-22)29(36)33(4)21(3)32-27)25-10-8-24(9-11-25)28(35)31-18-23-6-5-14-30-17-23/h5-14,16-17H,15,18-19H2,1-4H3,(H,31,35) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.40 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347391
(CHEMBL1801563)Show SMILES C\C=C\CN(Cc1ccccc1Cl)c1ccc(cc1)C(=O)NCc1cccnc1 Show InChI InChI=1S/C24H24ClN3O/c1-2-3-15-28(18-21-8-4-5-9-23(21)25)22-12-10-20(11-13-22)24(29)27-17-19-7-6-14-26-16-19/h2-14,16H,15,17-18H2,1H3,(H,27,29)/b3-2+ | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347406
(CHEMBL1801562)Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#7](-[#6]-c1ccccc1Cl)-c1ccc(cc1)-[#6](=O)-[#7]-[#6]-c1cccnc1 Show InChI InChI=1S/C25H26ClN3O/c1-19(2)13-15-29(18-22-7-3-4-8-24(22)26)23-11-9-21(10-12-23)25(30)28-17-20-6-5-14-27-16-20/h3-14,16H,15,17-18H2,1-2H3,(H,28,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347395
(CHEMBL1801567)Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#7](-[#6]-c1cc2c(cc1Cl)ncn(-[#6])c2=O)-c1ccc(cc1)-[#6](=O)-[#7]-[#6]-c1cccnc1 Show InChI InChI=1S/C28H28ClN5O2/c1-19(2)10-12-34(17-22-13-24-26(14-25(22)29)32-18-33(3)28(24)36)23-8-6-21(7-9-23)27(35)31-16-20-5-4-11-30-15-20/h4-11,13-15,18H,12,16-17H2,1-3H3,(H,31,35) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.60 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347401
(CHEMBL1801855)Show SMILES C\C=C\CN(Cc1ccc2nc(C)n(C)c(=O)c2c1)c1ccc(cc1)C(=O)NCc1cccnc1 Show InChI InChI=1S/C28H29N5O2/c1-4-5-15-33(19-21-8-13-26-25(16-21)28(35)32(3)20(2)31-26)24-11-9-23(10-12-24)27(34)30-18-22-7-6-14-29-17-22/h4-14,16-17H,15,18-19H2,1-3H3,(H,30,34)/b5-4+ | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347441
(CHEMBL568305)Show SMILES O=C(CCCCCCCn1cc(nn1)-c1cccnc1)Nc1ccccc1-c1ccccc1 Show InChI InChI=1S/C27H29N5O/c33-27(29-25-16-9-8-15-24(25)22-12-5-4-6-13-22)17-7-2-1-3-10-19-32-21-26(30-31-32)23-14-11-18-28-20-23/h4-6,8-9,11-16,18,20-21H,1-3,7,10,17,19H2,(H,29,33) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-mediated decrease in cellular NAD level |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347424
(CHEMBL1801937)Show SMILES Cc1nc2ccc(CN(CC#C)c3ccc(cc3)C(=O)NCc3cccnc3)cc2c(=O)n1C Show InChI InChI=1S/C27H25N5O2/c1-4-14-32(18-20-7-12-25-24(15-20)27(34)31(3)19(2)30-25)23-10-8-22(9-11-23)26(33)29-17-21-6-5-13-28-16-21/h1,5-13,15-16H,14,17-18H2,2-3H3,(H,29,33) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.60 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347430
(CHEMBL1801861)Show SMILES Cn1cnc2cc(Cl)c(NCc3ccc(cc3)C(=O)NCc3cccnc3)cc2c1=O Show InChI InChI=1S/C23H20ClN5O2/c1-29-14-28-20-10-19(24)21(9-18(20)23(29)31)26-12-15-4-6-17(7-5-15)22(30)27-13-16-3-2-8-25-11-16/h2-11,14,26H,12-13H2,1H3,(H,27,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 3.80 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347408
(CHEMBL1801560)Show SMILES Clc1ccccc1CN(CC#C)c1ccc(cc1)C(=O)NCc1cccnc1 Show InChI InChI=1S/C23H20ClN3O/c1-2-14-27(17-20-7-3-4-8-22(20)24)21-11-9-19(10-12-21)23(28)26-16-18-6-5-13-25-15-18/h1,3-13,15H,14,16-17H2,(H,26,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347442
(CHEMBL1801559)Show SMILES CC(C)CCN(Cc1ccccc1Cl)c1ccc(cc1)C(=O)NCc1cccnc1 Show InChI InChI=1S/C25H28ClN3O/c1-19(2)13-15-29(18-22-7-3-4-8-24(22)26)23-11-9-21(10-12-23)25(30)28-17-20-6-5-14-27-16-20/h3-12,14,16,19H,13,15,17-18H2,1-2H3,(H,28,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347426
(CHEMBL1801935)Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#7](-[#6]-c1cc2c(cc1Cl)nc(-[#6])n(-[#6])c2=O)-c1ccc(cc1)-[#6](=O)-[#7]-[#6]-c1cccnc1 Show InChI InChI=1S/C29H30ClN5O2/c1-19(2)11-13-35(18-23-14-25-27(15-26(23)30)33-20(3)34(4)29(25)37)24-9-7-22(8-10-24)28(36)32-17-21-6-5-12-31-16-21/h5-12,14-16H,13,17-18H2,1-4H3,(H,32,36) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347393
(CHEMBL1801565)Show SMILES Cn1cnc2ccc(CN(CC#C)c3ccc(cc3)C(=O)NCc3cccnc3)cc2c1=O Show InChI InChI=1S/C26H23N5O2/c1-3-13-31(17-19-6-11-24-23(14-19)26(33)30(2)18-29-24)22-9-7-21(8-10-22)25(32)28-16-20-5-4-12-27-15-20/h1,4-12,14-15,18H,13,16-17H2,2H3,(H,28,32) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347398
(CHEMBL1801570)Show SMILES Cn1cnc2cc(Cl)c(CN(CCC#C)c3ccc(cc3)C(=O)NCc3cccnc3)cc2c1=O Show InChI InChI=1S/C27H24ClN5O2/c1-3-4-12-33(17-21-13-23-25(14-24(21)28)31-18-32(2)27(23)35)22-9-7-20(8-10-22)26(34)30-16-19-6-5-11-29-15-19/h1,5-11,13-15,18H,4,12,16-17H2,2H3,(H,30,34) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347429
(CHEMBL1801860)Show SMILES Cn1cnc2cc(Cl)c(cc2c1=O)C(=O)Nc1ccc(cc1)C(=O)NCc1cccnc1 Show InChI InChI=1S/C23H18ClN5O3/c1-29-13-27-20-10-19(24)17(9-18(20)23(29)32)22(31)28-16-6-4-15(5-7-16)21(30)26-12-14-3-2-8-25-11-14/h2-11,13H,12H2,1H3,(H,26,30)(H,28,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347396
(CHEMBL1801568)Show SMILES Cn1cnc2cc(Cl)c(CN(CC3CC3)c3ccc(cc3)C(=O)NCc3cccnc3)cc2c1=O Show InChI InChI=1S/C27H26ClN5O2/c1-32-17-31-25-12-24(28)21(11-23(25)27(32)35)16-33(15-18-4-5-18)22-8-6-20(7-9-22)26(34)30-14-19-3-2-10-29-13-19/h2-3,6-13,17-18H,4-5,14-16H2,1H3,(H,30,34) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347411
(CHEMBL1801556)Show InChI InChI=1S/C23H24ClN3O/c1-2-14-27(17-20-7-3-4-8-22(20)24)21-11-9-19(10-12-21)23(28)26-16-18-6-5-13-25-15-18/h3-13,15H,2,14,16-17H2,1H3,(H,26,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347425
(CHEMBL1801936)Show SMILES CC(C)=CCN(Cc1cc2c(cc1Cl)nc(C)n(C)c2=O)c1ccc(cc1)C(=O)NCc1nc2ccccc2[nH]1 |(1.23,-37.16,;-.11,-36.39,;-1.44,-37.17,;-.11,-34.85,;-1.45,-34.09,;-1.45,-32.55,;-2.79,-31.78,;-4.12,-32.56,;-5.45,-31.79,;-6.78,-32.56,;-6.78,-34.1,;-5.45,-34.87,;-4.12,-34.1,;-2.78,-34.87,;-8.1,-34.86,;-9.43,-34.1,;-10.77,-34.87,;-9.43,-32.56,;-10.77,-31.79,;-8.1,-31.78,;-8.1,-30.24,;-.12,-31.77,;1.21,-32.54,;2.54,-31.77,;2.54,-30.23,;1.19,-29.46,;-.14,-30.24,;3.87,-29.45,;3.86,-27.91,;5.21,-30.21,;6.54,-29.44,;7.87,-30.2,;9.28,-29.57,;10.32,-30.71,;11.85,-30.7,;12.63,-32.02,;11.87,-33.36,;10.33,-33.37,;9.55,-32.04,;8.05,-31.73,)| Show InChI InChI=1S/C31H31ClN6O2/c1-19(2)13-14-38(18-22-15-24-28(16-25(22)32)34-20(3)37(4)31(24)40)23-11-9-21(10-12-23)30(39)33-17-29-35-26-7-5-6-8-27(26)36-29/h5-13,15-16H,14,17-18H2,1-4H3,(H,33,39)(H,35,36) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 25 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347439
(CHEMBL1801870)Show SMILES Cc1nc2CCN(Cc2c(=O)[nH]1)C(=O)Nc1ccc(cc1)C(=O)NCc1cccnc1 Show InChI InChI=1S/C22H22N6O3/c1-14-25-19-8-10-28(13-18(19)21(30)26-14)22(31)27-17-6-4-16(5-7-17)20(29)24-12-15-3-2-9-23-11-15/h2-7,9,11H,8,10,12-13H2,1H3,(H,24,29)(H,27,31)(H,25,26,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 29 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM81394
(MPI-0482594)Show SMILES Cn1c(CN2CCN(CCN)CC2)nc2cc(Cl)c(CN(CC#C)c3ccc(cc3)C(=O)NCc3ccccn3)cc2c1=O Show InChI InChI=1S/C33H37ClN8O2/c1-3-13-42(27-9-7-24(8-10-27)32(43)37-21-26-6-4-5-12-36-26)22-25-19-28-30(20-29(25)34)38-31(39(2)33(28)44)23-41-17-15-40(14-11-35)16-18-41/h1,4-10,12,19-20H,11,13-18,21-23,35H2,2H3,(H,37,43) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 29 | n/a | n/a | n/a | n/a | n/a | n/a |
Myriad Pharmaceuticals
| Assay Description
In vitro inhibition assay using human nampt, NMN adenylytransferase (nmant1)and UDP-glucose dehdryogenase (ugdh) genes. |
Chem Biol 17: 659-64 (2010)
Article DOI: 10.1016/j.chembiol.2010.05.008
BindingDB Entry DOI: 10.7270/Q2VT1QJW |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347444
(CHEMBL1801550)Show SMILES Cc1nc2ccc(CN(CC#C)c3ccc(cc3)C(=O)NCc3ccc(F)c(F)c3)cc2c(=O)n1C Show InChI InChI=1S/C28H24F2N4O2/c1-4-13-34(17-20-6-12-26-23(14-20)28(36)33(3)18(2)32-26)22-9-7-21(8-10-22)27(35)31-16-19-5-11-24(29)25(30)15-19/h1,5-12,14-15H,13,16-17H2,2-3H3,(H,31,35) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347414
(CHEMBL1801553)Show SMILES CC(C)=CCN(Cc1ccc2nc(C)n(C)c(=O)c2c1)c1ccc(cc1)C(=O)NCc1nc2ccccc2[nH]1 |(1.79,-27.5,;.45,-26.73,;-.88,-27.5,;.45,-25.19,;-.89,-24.42,;-.9,-22.88,;-2.23,-22.12,;-3.56,-22.89,;-3.56,-24.43,;-4.89,-25.2,;-6.22,-24.43,;-7.55,-25.2,;-8.87,-24.44,;-10.21,-25.21,;-8.87,-22.9,;-10.21,-22.13,;-7.55,-22.12,;-7.55,-20.58,;-6.22,-22.9,;-4.89,-22.13,;.44,-22.11,;1.77,-22.88,;3.1,-22.1,;3.1,-20.56,;1.75,-19.8,;.42,-20.57,;4.43,-19.78,;4.42,-18.24,;5.76,-20.55,;7.1,-19.77,;8.43,-20.54,;9.84,-19.9,;10.88,-21.04,;12.41,-21.03,;13.19,-22.35,;12.43,-23.69,;10.89,-23.7,;10.11,-22.38,;8.61,-22.07,)| Show InChI InChI=1S/C31H32N6O2/c1-20(2)15-16-37(19-22-9-14-26-25(17-22)31(39)36(4)21(3)33-26)24-12-10-23(11-13-24)30(38)32-18-29-34-27-7-5-6-8-28(27)35-29/h5-15,17H,16,18-19H2,1-4H3,(H,32,38)(H,34,35) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 31 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347420
(CHEMBL1801941)Show SMILES Cc1nc2ccc(CN(CC#C)c3ccc(cc3)C(=O)NCc3ccccc3F)cc2c(=O)n1C Show InChI InChI=1S/C28H25FN4O2/c1-4-15-33(18-20-9-14-26-24(16-20)28(35)32(3)19(2)31-26)23-12-10-21(11-13-23)27(34)30-17-22-7-5-6-8-25(22)29/h1,5-14,16H,15,17-18H2,2-3H3,(H,30,34) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 34 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347443
(CHEMBL1801933)Show SMILES Cc1nc2cc(Cl)c(CN(CC#C)c3ccc(cc3)C(=O)NCc3nc4ccccc4[nH]3)cc2c(=O)n1C Show InChI InChI=1S/C29H25ClN6O2/c1-4-13-36(17-20-14-22-26(15-23(20)30)32-18(2)35(3)29(22)38)21-11-9-19(10-12-21)28(37)31-16-27-33-24-7-5-6-8-25(24)34-27/h1,5-12,14-15H,13,16-17H2,2-3H3,(H,31,37)(H,33,34) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347419
(CHEMBL1801547)Show SMILES Cc1nc2ccc(CN(CC#C)c3ccc(cc3)C(=O)NCc3ccc(F)cc3F)cc2c(=O)n1C Show InChI InChI=1S/C28H24F2N4O2/c1-4-13-34(17-19-5-12-26-24(14-19)28(36)33(3)18(2)32-26)23-10-7-20(8-11-23)27(35)31-16-21-6-9-22(29)15-25(21)30/h1,5-12,14-15H,13,16-17H2,2-3H3,(H,31,35) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 49 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347397
(CHEMBL1801569)Show SMILES Cn1cnc2cc(Cl)c(CN(CC(N)=O)c3ccc(cc3)C(=O)NCc3cccnc3)cc2c1=O Show InChI InChI=1S/C25H23ClN6O3/c1-31-15-30-22-10-21(26)18(9-20(22)25(31)35)13-32(14-23(27)33)19-6-4-17(5-7-19)24(34)29-12-16-3-2-8-28-11-16/h2-11,15H,12-14H2,1H3,(H2,27,33)(H,29,34) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 56 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM81392
(MPI-0482593)Show SMILES CN1CCN(Cc2nc3cc(Cl)c(CN(CC#C)c4ccc(cc4)C(=O)NCc4ccccn4)cc3c(=O)n2C)CC1 Show InChI InChI=1S/C32H34ClN7O2/c1-4-13-40(26-10-8-23(9-11-26)31(41)35-20-25-7-5-6-12-34-25)21-24-18-27-29(19-28(24)33)36-30(38(3)32(27)42)22-39-16-14-37(2)15-17-39/h1,5-12,18-19H,13-17,20-22H2,2-3H3,(H,35,41) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 74 | n/a | n/a | n/a | n/a | n/a | n/a |
Myriad Pharmaceuticals
| Assay Description
In vitro inhibition assay using human nampt, NMN adenylytransferase (nmant1)and UDP-glucose dehdryogenase (ugdh) genes. |
Chem Biol 17: 659-64 (2010)
Article DOI: 10.1016/j.chembiol.2010.05.008
BindingDB Entry DOI: 10.7270/Q2VT1QJW |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347421
(CHEMBL1801940)Show SMILES Cc1nc2ccc(CN(CC#C)c3ccc(cc3)C(=O)NCc3ccc4OCOc4c3)cc2c(=O)n1C Show InChI InChI=1S/C29H26N4O4/c1-4-13-33(17-21-5-11-25-24(14-21)29(35)32(3)19(2)31-25)23-9-7-22(8-10-23)28(34)30-16-20-6-12-26-27(15-20)37-18-36-26/h1,5-12,14-15H,13,16-18H2,2-3H3,(H,30,34) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 85 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347436
(CHEMBL1801867)Show SMILES Cc1c(Sc2ccc(cc2)C(=O)NCCc2cccnc2)[nH]c2nc(N)nc(N)c12 Show InChI InChI=1S/C21H21N7OS/c1-12-16-17(22)26-21(23)28-18(16)27-20(12)30-15-6-4-14(5-7-15)19(29)25-10-8-13-3-2-9-24-11-13/h2-7,9,11H,8,10H2,1H3,(H,25,29)(H5,22,23,26,27,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 90 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347418
(CHEMBL1801548)Show SMILES Cc1nc2ccc(CN(CC#C)c3ccc(cc3)C(=O)NCc3ccc(F)c(F)c3F)cc2c(=O)n1C Show InChI InChI=1S/C28H23F3N4O2/c1-4-13-35(16-18-5-12-24-22(14-18)28(37)34(3)17(2)33-24)21-9-6-19(7-10-21)27(36)32-15-20-8-11-23(29)26(31)25(20)30/h1,5-12,14H,13,15-16H2,2-3H3,(H,32,36) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 98 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347392
(CHEMBL1801564)Show SMILES Clc1ccccc1CN(Cc1ccccc1)c1ccc(cc1)C(=O)NCc1cccnc1 Show InChI InChI=1S/C27H24ClN3O/c28-26-11-5-4-10-24(26)20-31(19-21-7-2-1-3-8-21)25-14-12-23(13-15-25)27(32)30-18-22-9-6-16-29-17-22/h1-17H,18-20H2,(H,30,32) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 110 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347423
(CHEMBL1801938)Show SMILES Cc1nc2ccc(CN(CC#C)c3ccc(cc3)C(=O)NCc3nc4ccccc4[nH]3)cc2c(=O)n1C Show InChI InChI=1S/C29H26N6O2/c1-4-15-35(18-20-9-14-24-23(16-20)29(37)34(3)19(2)31-24)22-12-10-21(11-13-22)28(36)30-17-27-32-25-7-5-6-8-26(25)33-27/h1,5-14,16H,15,17-18H2,2-3H3,(H,30,36)(H,32,33) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 130 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347417
(CHEMBL1801549)Show SMILES Cc1nc2ccc(CN(CC#C)c3ccc(cc3)C(=O)NCc3ccc(Cl)cc3)cc2c(=O)n1C Show InChI InChI=1S/C28H25ClN4O2/c1-4-15-33(18-21-7-14-26-25(16-21)28(35)32(3)19(2)31-26)24-12-8-22(9-13-24)27(34)30-17-20-5-10-23(29)11-6-20/h1,5-14,16H,15,17-18H2,2-3H3,(H,30,34) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 150 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Thymidylate synthase
(Homo sapiens (Human)) | BDBM50347390
(CHEMBL1801872)Show SMILES Cc1nc2cc(Br)c(CN(CC#C)c3ccc(cc3)C(=O)NCc3ccccn3)cc2c(=O)[nH]1 Show InChI InChI=1S/C26H22BrN5O2/c1-3-12-32(16-19-13-22-24(14-23(19)27)30-17(2)31-26(22)34)21-9-7-18(8-10-21)25(33)29-15-20-6-4-5-11-28-20/h1,4-11,13-14H,12,15-16H2,2H3,(H,29,33)(H,30,31,34) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 156 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of thymidylate synthase |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Thymidylate synthase
(Homo sapiens (Human)) | BDBM50117203
(4-[(7-Bromo-2-methyl-4-oxo-3,4-dihydro-quinazolin-...)Show SMILES Cc1nc2cc(Br)c(CN(CC#C)c3ccc(cc3)C(=O)NCc3cccnc3)cc2c(=O)[nH]1 Show InChI InChI=1S/C26H22BrN5O2/c1-3-11-32(16-20-12-22-24(13-23(20)27)30-17(2)31-26(22)34)21-8-6-19(7-9-21)25(33)29-15-18-5-4-10-28-14-18/h1,4-10,12-14H,11,15-16H2,2H3,(H,29,33)(H,30,31,34) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 156 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of thymidylate synthase |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Thymidylate synthase
(Homo sapiens (Human)) | BDBM50347428
(CHEMBL1801873)Show SMILES Cc1nc2cc(Br)c(CN(CC#C)c3ccc(cc3)C(=O)NCc3ccncc3)cc2c(=O)[nH]1 Show InChI InChI=1S/C26H22BrN5O2/c1-3-12-32(16-20-13-22-24(14-23(20)27)30-17(2)31-26(22)34)21-6-4-19(5-7-21)25(33)29-15-18-8-10-28-11-9-18/h1,4-11,13-14H,12,15-16H2,2H3,(H,29,33)(H,30,31,34) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 156 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of thymidylate synthase |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347400
(CHEMBL1801854)Show SMILES Cc1noc(C)c1CN(Cc1ccc2nc(C)n(C)c(=O)c2c1)c1ccc(cc1)C(=O)NCc1cccnc1 Show InChI InChI=1S/C30H30N6O3/c1-19-27(20(2)39-34-19)18-36(17-22-7-12-28-26(14-22)30(38)35(4)21(3)33-28)25-10-8-24(9-11-25)29(37)32-16-23-6-5-13-31-15-23/h5-15H,16-18H2,1-4H3,(H,32,37) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 210 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347416
(CHEMBL1801551)Show SMILES Cc1nc2ccc(CN(CC#C)c3ccc(cc3)C(=O)NCc3cccc(F)c3)cc2c(=O)n1C Show InChI InChI=1S/C28H25FN4O2/c1-4-14-33(18-21-8-13-26-25(16-21)28(35)32(3)19(2)31-26)24-11-9-22(10-12-24)27(34)30-17-20-6-5-7-23(29)15-20/h1,5-13,15-16H,14,17-18H2,2-3H3,(H,30,34) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 250 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347412
(CHEMBL1801555)Show InChI InChI=1S/C22H22ClN3O/c1-2-26(16-19-7-3-4-8-21(19)23)20-11-9-18(10-12-20)22(27)25-15-17-6-5-13-24-14-17/h3-14H,2,15-16H2,1H3,(H,25,27) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 330 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
Nicotinamide phosphoribosyltransferase
(Homo sapiens (Human)) | BDBM50347409
(CHEMBL1801558)Show SMILES CC(C)CN(Cc1ccccc1Cl)c1ccc(cc1)C(=O)NCc1cccnc1 Show InChI InChI=1S/C24H26ClN3O/c1-18(2)16-28(17-21-7-3-4-8-23(21)25)22-11-9-20(10-12-22)24(29)27-15-19-6-5-13-26-14-19/h3-14,18H,15-17H2,1-2H3,(H,27,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 420 | n/a | n/a | n/a | n/a | n/a | n/a |
Myrexis, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of nicotinamide phosphoribosyltransferase-catalyzed conversion of nicotinamide to nicotinamide mononucleotide |
J Med Chem 53: 8734-46 (2010)
Article DOI: 10.1021/jm101145b
BindingDB Entry DOI: 10.7270/Q26H4HSP |
More data for this
Ligand-Target Pair | |
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