Found 72 hits of kd for UniProtKB: P22392 Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kcal/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50233219
(CHEMBL4105151)Show SMILES CN1CCN(CC1)c1cc2nc3\C(CCn3c(=O)c2cc1F)=C\c1ccc(NC(=O)CCN2CCN(CCO)CC2)cc1 Show InChI InChI=1S/C32H40FN7O3/c1-36-10-16-39(17-11-36)29-22-28-26(21-27(29)33)32(43)40-9-6-24(31(40)35-28)20-23-2-4-25(5-3-23)34-30(42)7-8-37-12-14-38(15-13-37)18-19-41/h2-5,20-22,41H,6-19H2,1H3,(H,34,42)/b24-20+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.80E+3 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to NT647-labeled His-tagged NM23-H2 (unknown origin) expressed in Escherichia coli BL21(DE3) after 30 mins by microscale thermophore... |
J Med Chem 60: 1292-1308 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01218
BindingDB Entry DOI: 10.7270/Q2251MFM |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240759
(CHEMBL4104243)Show SMILES CN(C)CCCNc1cc2nc3\C(CCn3c(=O)c2cc1F)=C\c1ccc(OCc2ccccc2)cc1O Show InChI InChI=1S/C30H31FN4O3/c1-34(2)13-6-12-32-27-18-26-24(17-25(27)31)30(37)35-14-11-22(29(35)33-26)15-21-9-10-23(16-28(21)36)38-19-20-7-4-3-5-8-20/h3-5,7-10,15-18,32,36H,6,11-14,19H2,1-2H3/b22-15+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to N-terminal NT-647-NHS labeled NM23-H2 (unknown origin) after 30 mins by MST analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240759
(CHEMBL4104243)Show SMILES CN(C)CCCNc1cc2nc3\C(CCn3c(=O)c2cc1F)=C\c1ccc(OCc2ccccc2)cc1O Show InChI InChI=1S/C30H31FN4O3/c1-34(2)13-6-12-32-27-18-26-24(17-25(27)31)30(37)35-14-11-22(29(35)33-26)15-21-9-10-23(16-28(21)36)38-19-20-7-4-3-5-8-20/h3-5,7-10,15-18,32,36H,6,11-14,19H2,1-2H3/b22-15+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 3.10E+3 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to NM23-H2 (unknown origin) by SPR analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240729
(CHEMBL4063228)Show SMILES CCN(CC)CCCNc1cc2nc3\C(CCn3c(=O)c2cc1F)=C\c1ccc(OCc2ccccc2)cc1O Show InChI InChI=1S/C32H35FN4O3/c1-3-36(4-2)15-8-14-34-29-20-28-26(19-27(29)33)32(39)37-16-13-24(31(37)35-28)17-23-11-12-25(18-30(23)38)40-21-22-9-6-5-7-10-22/h5-7,9-12,17-20,34,38H,3-4,8,13-16,21H2,1-2H3/b24-17+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 3.40E+3 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to N-terminal NT-647-NHS labeled NM23-H2 (unknown origin) after 30 mins by MST analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240729
(CHEMBL4063228)Show SMILES CCN(CC)CCCNc1cc2nc3\C(CCn3c(=O)c2cc1F)=C\c1ccc(OCc2ccccc2)cc1O Show InChI InChI=1S/C32H35FN4O3/c1-3-36(4-2)15-8-14-34-29-20-28-26(19-27(29)33)32(39)37-16-13-24(31(37)35-28)17-23-11-12-25(18-30(23)38)40-21-22-9-6-5-7-10-22/h5-7,9-12,17-20,34,38H,3-4,8,13-16,21H2,1-2H3/b24-17+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 4.60E+3 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Inhibitory activity against human renin |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240760
(CHEMBL4102519)Show SMILES CN(C)CCNc1cc2nc3\C(CCn3c(=O)c2cc1F)=C\c1ccc(OCc2ccccc2)cc1O Show InChI InChI=1S/C29H29FN4O3/c1-33(2)13-11-31-26-17-25-23(16-24(26)30)29(36)34-12-10-21(28(34)32-25)14-20-8-9-22(15-27(20)35)37-18-19-6-4-3-5-7-19/h3-9,14-17,31,35H,10-13,18H2,1-2H3/b21-14+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | 6.40E+3 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to N-terminal NT-647-NHS labeled NM23-H2 (unknown origin) after 30 mins by MST analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240740
(CHEMBL4090566)Show SMILES Oc1cc(OCc2ccccc2)ccc1\C=C1/CCn2c1nc1cc(NCCN3CCCCC3)c(F)cc1c2=O Show InChI InChI=1S/C32H33FN4O3/c33-27-19-26-28(20-29(27)34-12-16-36-13-5-2-6-14-36)35-31-24(11-15-37(31)32(26)39)17-23-9-10-25(18-30(23)38)40-21-22-7-3-1-4-8-22/h1,3-4,7-10,17-20,34,38H,2,5-6,11-16,21H2/b24-17+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 7.60E+3 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to N-terminal NT-647-NHS labeled NM23-H2 (unknown origin) after 30 mins by MST analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240764
(CHEMBL4095292)Show SMILES CCN(CC)CCCNC(=O)c1ccc(\C=C2/CCn3c2nc2cc(NCCN4CCCC4)c(F)cc2c3=O)cc1 Show InChI InChI=1S/C32H41FN6O2/c1-3-37(4-2)17-7-13-35-31(40)24-10-8-23(9-11-24)20-25-12-18-39-30(25)36-28-22-29(27(33)21-26(28)32(39)41)34-14-19-38-15-5-6-16-38/h8-11,20-22,34H,3-7,12-19H2,1-2H3,(H,35,40)/b25-20+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 7.60E+3 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to NM23-H2 (unknown origin) by SPR analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240760
(CHEMBL4102519)Show SMILES CN(C)CCNc1cc2nc3\C(CCn3c(=O)c2cc1F)=C\c1ccc(OCc2ccccc2)cc1O Show InChI InChI=1S/C29H29FN4O3/c1-33(2)13-11-31-26-17-25-23(16-24(26)30)29(36)34-12-10-21(28(34)32-25)14-20-8-9-22(15-27(20)35)37-18-19-6-4-3-5-7-19/h3-9,14-17,31,35H,10-13,18H2,1-2H3/b21-14+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | 8.10E+3 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to NM23-H2 (unknown origin) by SPR analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240756
(CHEMBL4101313)Show SMILES CN(C)CCCNc1cc2nc3\C(CCn3c(=O)c2cc1F)=C\c1ccc(\C=C\c2ccccn2)cc1 Show InChI InChI=1S/C30H30FN5O/c1-35(2)16-5-15-33-28-20-27-25(19-26(28)31)30(37)36-17-13-23(29(36)34-27)18-22-9-7-21(8-10-22)11-12-24-6-3-4-14-32-24/h3-4,6-12,14,18-20,33H,5,13,15-17H2,1-2H3/b12-11+,23-18+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 8.50E+3 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to NM23-H2 (unknown origin) by SPR analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240754
(CHEMBL4103750)Show SMILES CN(C)CCCNc1cc2nc3\C(CCn3c(=O)c2cc1F)=C\c1ccc(OCC#C)cc1 Show InChI InChI=1S/C26H27FN4O2/c1-4-14-33-20-8-6-18(7-9-20)15-19-10-13-31-25(19)29-23-17-24(28-11-5-12-30(2)3)22(27)16-21(23)26(31)32/h1,6-9,15-17,28H,5,10-14H2,2-3H3/b19-15+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 8.90E+3 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to N-terminal NT-647-NHS labeled NM23-H2 (unknown origin) after 30 mins by MST analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240722
(CHEMBL4077960)Show SMILES CN(C)CCCNc1cc2nc3\C(CCn3c(=O)c2cc1F)=C\c1ccc(O)c(O)c1 Show InChI InChI=1S/C23H25FN4O3/c1-27(2)8-3-7-25-19-13-18-16(12-17(19)24)23(31)28-9-6-15(22(28)26-18)10-14-4-5-20(29)21(30)11-14/h4-5,10-13,25,29-30H,3,6-9H2,1-2H3/b15-10+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 9.20E+3 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to NM23-H2 (unknown origin) by SPR analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240723
(CHEMBL4085831)Show SMILES CC(C)Oc1ccc(\C=C2/CCn3c2nc2cc(NCCCN(C)C)c(F)cc2c3=O)cc1 Show InChI InChI=1S/C26H31FN4O2/c1-17(2)33-20-8-6-18(7-9-20)14-19-10-13-31-25(19)29-23-16-24(28-11-5-12-30(3)4)22(27)15-21(23)26(31)32/h6-9,14-17,28H,5,10-13H2,1-4H3/b19-14+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 9.60E+3 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Inhibitory activity against porcine renin |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240755
(CHEMBL4074606)Show SMILES CN(C)CCCNc1cc2nc3\C(CCn3c(=O)c2cc1F)=C\c1ccc(OC(C)=O)cc1 Show InChI InChI=1S/C25H27FN4O3/c1-16(31)33-19-7-5-17(6-8-19)13-18-9-12-30-24(18)28-22-15-23(27-10-4-11-29(2)3)21(26)14-20(22)25(30)32/h5-8,13-15,27H,4,9-12H2,1-3H3/b18-13+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.01E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to NM23-H2 (unknown origin) by SPR analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50233220
(CHEMBL4079924)Show SMILES O=C(CCN1CCCC1)Nc1ccc(\C=C2/CCCn3c2nc2cc(NC(=O)CCN4CCCC4)ccc2c3=O)cc1 Show InChI InChI=1S/C33H40N6O3/c40-30(13-20-37-15-1-2-16-37)34-26-9-7-24(8-10-26)22-25-6-5-19-39-32(25)36-29-23-27(11-12-28(29)33(39)42)35-31(41)14-21-38-17-3-4-18-38/h7-12,22-23H,1-6,13-21H2,(H,34,40)(H,35,41)/b25-22+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.04E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to NM23-H2 (unknown origin) by SPR analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240722
(CHEMBL4077960)Show SMILES CN(C)CCCNc1cc2nc3\C(CCn3c(=O)c2cc1F)=C\c1ccc(O)c(O)c1 Show InChI InChI=1S/C23H25FN4O3/c1-27(2)8-3-7-25-19-13-18-16(12-17(19)24)23(31)28-9-6-15(22(28)26-18)10-14-4-5-20(29)21(30)11-14/h4-5,10-13,25,29-30H,3,6-9H2,1-2H3/b15-10+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.07E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to N-terminal NT-647-NHS labeled NM23-H2 (unknown origin) after 30 mins by MST analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240741
(CHEMBL4078248)Show SMILES Oc1cc(OCc2ccccc2)ccc1\C=C1/CCn2c1nc1cc(NCCCN3CCCC3)c(F)cc1c2=O Show InChI InChI=1S/C32H33FN4O3/c33-27-19-26-28(20-29(27)34-12-6-15-36-13-4-5-14-36)35-31-24(11-16-37(31)32(26)39)17-23-9-10-25(18-30(23)38)40-21-22-7-2-1-3-8-22/h1-3,7-10,17-20,34,38H,4-6,11-16,21H2/b24-17+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.08E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to N-terminal NT-647-NHS labeled NM23-H2 (unknown origin) after 30 mins by MST analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240756
(CHEMBL4101313)Show SMILES CN(C)CCCNc1cc2nc3\C(CCn3c(=O)c2cc1F)=C\c1ccc(\C=C\c2ccccn2)cc1 Show InChI InChI=1S/C30H30FN5O/c1-35(2)16-5-15-33-28-20-27-25(19-26(28)31)30(37)36-17-13-23(29(36)34-27)18-22-9-7-21(8-10-22)11-12-24-6-3-4-14-32-24/h3-4,6-12,14,18-20,33H,5,13,15-17H2,1-2H3/b12-11+,23-18+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.08E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to N-terminal NT-647-NHS labeled NM23-H2 (unknown origin) after 30 mins by MST analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240741
(CHEMBL4078248)Show SMILES Oc1cc(OCc2ccccc2)ccc1\C=C1/CCn2c1nc1cc(NCCCN3CCCC3)c(F)cc1c2=O Show InChI InChI=1S/C32H33FN4O3/c33-27-19-26-28(20-29(27)34-12-6-15-36-13-4-5-14-36)35-31-24(11-16-37(31)32(26)39)17-23-9-10-25(18-30(23)38)40-21-22-7-2-1-3-8-22/h1-3,7-10,17-20,34,38H,4-6,11-16,21H2/b24-17+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.15E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to NM23-H2 (unknown origin) by SPR analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240732
(CHEMBL4103917)Show SMILES CCN(CC)CCCNc1cc2nc3\C(CCn3c(=O)c2cc1F)=C\c1ccc(cc1O)N(CC)CC Show InChI InChI=1S/C29H38FN5O2/c1-5-33(6-2)14-9-13-31-26-19-25-23(18-24(26)30)29(37)35-15-12-21(28(35)32-25)16-20-10-11-22(17-27(20)36)34(7-3)8-4/h10-11,16-19,31,36H,5-9,12-15H2,1-4H3/b21-16+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.17E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to N-terminal NT-647-NHS labeled NM23-H2 (unknown origin) after 30 mins by MST analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240740
(CHEMBL4090566)Show SMILES Oc1cc(OCc2ccccc2)ccc1\C=C1/CCn2c1nc1cc(NCCN3CCCCC3)c(F)cc1c2=O Show InChI InChI=1S/C32H33FN4O3/c33-27-19-26-28(20-29(27)34-12-16-36-13-5-2-6-14-36)35-31-24(11-15-37(31)32(26)39)17-23-9-10-25(18-30(23)38)40-21-22-7-3-1-4-8-22/h1,3-4,7-10,17-20,34,38H,2,5-6,11-16,21H2/b24-17+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.22E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to NM23-H2 (unknown origin) by SPR analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240724
(CHEMBL4065975)Show SMILES CN(C)CCCNc1cc2nc3\C(CCn3c(=O)c2cc1F)=C\c1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C29H29FN4O2/c1-33(2)15-6-14-31-27-19-26-24(18-25(27)30)29(35)34-16-13-21(28(34)32-26)17-20-9-11-23(12-10-20)36-22-7-4-3-5-8-22/h3-5,7-12,17-19,31H,6,13-16H2,1-2H3/b21-17+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.24E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to NM23-H2 (unknown origin) by SPR analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240746
(CHEMBL4086337)Show SMILES CN(C)CCCNc1cc2nc3\C(CCn3c(=O)c2cc1F)=C\c1ccc(OCc2ccccc2)c(O)c1 Show InChI InChI=1S/C30H31FN4O3/c1-34(2)13-6-12-32-26-18-25-23(17-24(26)31)30(37)35-14-11-22(29(35)33-25)15-21-9-10-28(27(36)16-21)38-19-20-7-4-3-5-8-20/h3-5,7-10,15-18,32,36H,6,11-14,19H2,1-2H3/b22-15+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.32E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to NM23-H2 (unknown origin) by SPR analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240719
(CHEMBL4096008)Show SMILES COc1cc(\C=C2/CCn3c2nc2cc(NCCCN(C)C)c(F)cc2c3=O)cc(OC)c1O Show InChI InChI=1S/C25H29FN4O4/c1-29(2)8-5-7-27-20-14-19-17(13-18(20)26)25(32)30-9-6-16(24(30)28-19)10-15-11-21(33-3)23(31)22(12-15)34-4/h10-14,27,31H,5-9H2,1-4H3/b16-10+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.33E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to NM23-H2 (unknown origin) by SPR analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240734
(CHEMBL4076101)Show SMILES CCN(CC)CCCNc1cc2nc3\C(CCn3c(=O)c2cc1F)=C\c1ccc(\C=C\c2ccccn2)cc1 Show InChI InChI=1S/C32H34FN5O/c1-3-37(4-2)18-7-17-35-30-22-29-27(21-28(30)33)32(39)38-19-15-25(31(38)36-29)20-24-11-9-23(10-12-24)13-14-26-8-5-6-16-34-26/h5-6,8-14,16,20-22,35H,3-4,7,15,17-19H2,1-2H3/b14-13+,25-20+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.38E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to NM23-H2 (unknown origin) by SPR analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240732
(CHEMBL4103917)Show SMILES CCN(CC)CCCNc1cc2nc3\C(CCn3c(=O)c2cc1F)=C\c1ccc(cc1O)N(CC)CC Show InChI InChI=1S/C29H38FN5O2/c1-5-33(6-2)14-9-13-31-26-19-25-23(18-24(26)30)29(37)35-15-12-21(28(35)32-25)16-20-10-11-22(17-27(20)36)34(7-3)8-4/h10-11,16-19,31,36H,5-9,12-15H2,1-4H3/b21-16+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.39E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to NM23-H2 (unknown origin) by SPR analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240742
(CHEMBL4098152)Show SMILES Oc1cc(OCc2ccccc2)ccc1\C=C1/CCn2c1nc1cc(NCCCN3CCOCC3)c(F)cc1c2=O Show InChI InChI=1S/C32H33FN4O4/c33-27-19-26-28(20-29(27)34-10-4-11-36-13-15-40-16-14-36)35-31-24(9-12-37(31)32(26)39)17-23-7-8-25(18-30(23)38)41-21-22-5-2-1-3-6-22/h1-3,5-8,17-20,34,38H,4,9-16,21H2/b24-17+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| n/a | n/a | n/a | 1.43E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to NM23-H2 (unknown origin) by SPR analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240733
(CHEMBL4077352)Show SMILES CCN(CC)CCCNc1cc2nc3\C(CCn3c(=O)c2cc1F)=C\c1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C32H35FN4O2/c1-3-36(4-2)17-8-16-34-30-21-29-27(20-28(30)33)32(38)37-18-15-25(31(37)35-29)19-23-11-13-26(14-12-23)39-22-24-9-6-5-7-10-24/h5-7,9-14,19-21,34H,3-4,8,15-18,22H2,1-2H3/b25-19+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.46E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to NM23-H2 (unknown origin) by SPR analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240723
(CHEMBL4085831)Show SMILES CC(C)Oc1ccc(\C=C2/CCn3c2nc2cc(NCCCN(C)C)c(F)cc2c3=O)cc1 Show InChI InChI=1S/C26H31FN4O2/c1-17(2)33-20-8-6-18(7-9-20)14-19-10-13-31-25(19)29-23-16-24(28-11-5-12-30(3)4)22(27)15-21(23)26(31)32/h6-9,14-17,28H,5,10-13H2,1-4H3/b19-14+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.54E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to N-terminal NT-647-NHS labeled NM23-H2 (unknown origin) after 30 mins by MST analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240737
(CHEMBL4073986)Show SMILES CCN(CC)CCCNc1cc2nc3\C(CCn3c(=O)c2cc1F)=C\c1ccc(OC)cc1 Show InChI InChI=1S/C26H31FN4O2/c1-4-30(5-2)13-6-12-28-24-17-23-21(16-22(24)27)26(32)31-14-11-19(25(31)29-23)15-18-7-9-20(33-3)10-8-18/h7-10,15-17,28H,4-6,11-14H2,1-3H3/b19-15+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.54E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to NM23-H2 (unknown origin) by SPR analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240753
(CHEMBL4066570)Show SMILES COc1ccc(\C=C2/CCn3c2nc2cc(NCCCN(C)C)c(F)cc2c3=O)cc1OC Show InChI InChI=1S/C25H29FN4O3/c1-29(2)10-5-9-27-21-15-20-18(14-19(21)26)25(31)30-11-8-17(24(30)28-20)12-16-6-7-22(32-3)23(13-16)33-4/h6-7,12-15,27H,5,8-11H2,1-4H3/b17-12+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.58E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to NM23-H2 (unknown origin) by SPR analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240746
(CHEMBL4086337)Show SMILES CN(C)CCCNc1cc2nc3\C(CCn3c(=O)c2cc1F)=C\c1ccc(OCc2ccccc2)c(O)c1 Show InChI InChI=1S/C30H31FN4O3/c1-34(2)13-6-12-32-26-18-25-23(17-24(26)31)30(37)35-14-11-22(29(35)33-25)15-21-9-10-28(27(36)16-21)38-19-20-7-4-3-5-8-20/h3-5,7-10,15-18,32,36H,6,11-14,19H2,1-2H3/b22-15+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.61E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to N-terminal NT-647-NHS labeled NM23-H2 (unknown origin) after 30 mins by MST analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240724
(CHEMBL4065975)Show SMILES CN(C)CCCNc1cc2nc3\C(CCn3c(=O)c2cc1F)=C\c1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C29H29FN4O2/c1-33(2)15-6-14-31-27-19-26-24(18-25(27)30)29(35)34-16-13-21(28(34)32-26)17-20-9-11-23(12-10-20)36-22-7-4-3-5-8-22/h3-5,7-12,17-19,31H,6,13-16H2,1-2H3/b21-17+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.63E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to N-terminal NT-647-NHS labeled NM23-H2 (unknown origin) after 30 mins by MST analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240757
(CHEMBL4071264)Show SMILES CCN(CC)CCCNc1cc2nc3\C(CCn3c(=O)c2cc1F)=C\c1cc(OC)c(OC)c(OC)c1 Show InChI InChI=1S/C28H35FN4O4/c1-6-32(7-2)11-8-10-30-23-17-22-20(16-21(23)29)28(34)33-12-9-19(27(33)31-22)13-18-14-24(35-3)26(37-5)25(15-18)36-4/h13-17,30H,6-12H2,1-5H3/b19-13+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.63E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to NM23-H2 (unknown origin) by SPR analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240719
(CHEMBL4096008)Show SMILES COc1cc(\C=C2/CCn3c2nc2cc(NCCCN(C)C)c(F)cc2c3=O)cc(OC)c1O Show InChI InChI=1S/C25H29FN4O4/c1-29(2)8-5-7-27-20-14-19-17(13-18(20)26)25(32)30-9-6-16(24(30)28-19)10-15-11-21(33-3)23(31)22(12-15)34-4/h10-14,27,31H,5-9H2,1-4H3/b16-10+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.65E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to N-terminal NT-647-NHS labeled NM23-H2 (unknown origin) after 30 mins by MST analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240727
(CHEMBL4084873)Show SMILES CCN(CC)CCCNc1cc2nc3\C(CCn3c(=O)c2cc1F)=C\c1ccc(OCc2ccccc2)c(O)c1 Show InChI InChI=1S/C32H35FN4O3/c1-3-36(4-2)15-8-14-34-28-20-27-25(19-26(28)33)32(39)37-16-13-24(31(37)35-27)17-23-11-12-30(29(38)18-23)40-21-22-9-6-5-7-10-22/h5-7,9-12,17-20,34,38H,3-4,8,13-16,21H2,1-2H3/b24-17+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.67E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to NM23-H2 (unknown origin) by SPR analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240718
(CHEMBL4094111)Show SMILES COc1cc(\C=C2/CCn3c2nc2cc(NCCCN(C)C)c(F)cc2c3=O)cc(OC)c1OC Show InChI InChI=1S/C26H31FN4O4/c1-30(2)9-6-8-28-21-15-20-18(14-19(21)27)26(32)31-10-7-17(25(31)29-20)11-16-12-22(33-3)24(35-5)23(13-16)34-4/h11-15,28H,6-10H2,1-5H3/b17-11+ | PDB
UniProtKB/SwissProt
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| CHEMBL
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PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.68E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to NM23-H2 (unknown origin) by SPR analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240742
(CHEMBL4098152)Show SMILES Oc1cc(OCc2ccccc2)ccc1\C=C1/CCn2c1nc1cc(NCCCN3CCOCC3)c(F)cc1c2=O Show InChI InChI=1S/C32H33FN4O4/c33-27-19-26-28(20-29(27)34-10-4-11-36-13-15-40-16-14-36)35-31-24(9-12-37(31)32(26)39)17-23-7-8-25(18-30(23)38)41-21-22-5-2-1-3-6-22/h1-3,5-8,17-20,34,38H,4,9-16,21H2/b24-17+ | PDB
UniProtKB/SwissProt
antibodypedia
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| CHEMBL
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UniChem
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| Article
PubMed
| n/a | n/a | n/a | 1.69E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to N-terminal NT-647-NHS labeled NM23-H2 (unknown origin) after 30 mins by MST analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240731
(CHEMBL4092067)Show SMILES CCN(CC)CCCNc1cc2nc3\C(CCn3c(=O)c2cc1F)=C\c1ccc(OC)c(OC)c1 Show InChI InChI=1S/C27H33FN4O3/c1-5-31(6-2)12-7-11-29-23-17-22-20(16-21(23)28)27(33)32-13-10-19(26(32)30-22)14-18-8-9-24(34-3)25(15-18)35-4/h8-9,14-17,29H,5-7,10-13H2,1-4H3/b19-14+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | 1.71E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Inhibitory activity against porcine renin |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240735
(CHEMBL4070857)Show SMILES Fc1cc2c(cc1NCCN1CCCC1)nc1\C(CCn1c2=O)=C\c1ccc(cc1)C(=O)NCCCN1CCCC1 Show InChI InChI=1S/C32H39FN6O2/c33-27-21-26-28(22-29(27)34-12-19-38-15-3-4-16-38)36-30-25(10-18-39(30)32(26)41)20-23-6-8-24(9-7-23)31(40)35-11-5-17-37-13-1-2-14-37/h6-9,20-22,34H,1-5,10-19H2,(H,35,40)/b25-20+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.80E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to N-terminal NT-647-NHS labeled NM23-H2 (unknown origin) after 30 mins by MST analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240744
(CHEMBL4079211)Show SMILES Fc1cc2c(cc1NCCCN1CCOCC1)nc1\C(CCn1c2=O)=C\c1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C32H33FN4O3/c33-28-20-27-29(21-30(28)34-12-4-13-36-15-17-39-18-16-36)35-31-25(11-14-37(31)32(27)38)19-23-7-9-26(10-8-23)40-22-24-5-2-1-3-6-24/h1-3,5-10,19-21,34H,4,11-18,22H2/b25-19+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.84E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to NM23-H2 (unknown origin) by SPR analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240718
(CHEMBL4094111)Show SMILES COc1cc(\C=C2/CCn3c2nc2cc(NCCCN(C)C)c(F)cc2c3=O)cc(OC)c1OC Show InChI InChI=1S/C26H31FN4O4/c1-30(2)9-6-8-28-21-15-20-18(14-19(21)27)26(32)31-10-7-17(25(31)29-20)11-16-12-22(33-3)24(35-5)23(13-16)34-4/h11-15,28H,6-10H2,1-5H3/b17-11+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
MMDB
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.84E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to N-terminal NT-647-NHS labeled NM23-H2 (unknown origin) after 30 mins by MST analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240743
(CHEMBL4097029)Show SMILES COc1cc(\C=C2/CCn3c2nc2cc(NCCCN4CCOCC4)c(F)cc2c3=O)cc(OC)c1OC Show InChI InChI=1S/C28H33FN4O5/c1-35-24-14-18(15-25(36-2)26(24)37-3)13-19-5-8-33-27(19)31-22-17-23(21(29)16-20(22)28(33)34)30-6-4-7-32-9-11-38-12-10-32/h13-17,30H,4-12H2,1-3H3/b19-13+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.85E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to NM23-H2 (unknown origin) by SPR analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240755
(CHEMBL4074606)Show SMILES CN(C)CCCNc1cc2nc3\C(CCn3c(=O)c2cc1F)=C\c1ccc(OC(C)=O)cc1 Show InChI InChI=1S/C25H27FN4O3/c1-16(31)33-19-7-5-17(6-8-19)13-18-9-12-30-24(18)28-22-15-23(27-10-4-11-29(2)3)21(26)14-20(22)25(30)32/h5-8,13-15,27H,4,9-12H2,1-3H3/b18-13+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.89E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to N-terminal NT-647-NHS labeled NM23-H2 (unknown origin) after 30 mins by MST analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240753
(CHEMBL4066570)Show SMILES COc1ccc(\C=C2/CCn3c2nc2cc(NCCCN(C)C)c(F)cc2c3=O)cc1OC Show InChI InChI=1S/C25H29FN4O3/c1-29(2)10-5-9-27-21-15-20-18(14-19(21)26)25(31)30-11-8-17(24(30)28-20)12-16-6-7-22(32-3)23(13-16)33-4/h6-7,12-15,27H,5,8-11H2,1-4H3/b17-12+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.92E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to N-terminal NT-647-NHS labeled NM23-H2 (unknown origin) after 30 mins by MST analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240735
(CHEMBL4070857)Show SMILES Fc1cc2c(cc1NCCN1CCCC1)nc1\C(CCn1c2=O)=C\c1ccc(cc1)C(=O)NCCCN1CCCC1 Show InChI InChI=1S/C32H39FN6O2/c33-27-21-26-28(22-29(27)34-12-19-38-15-3-4-16-38)36-30-25(10-18-39(30)32(26)41)20-23-6-8-24(9-7-23)31(40)35-11-5-17-37-13-1-2-14-37/h6-9,20-22,34H,1-5,10-19H2,(H,35,40)/b25-20+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.98E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Inhibitory activity against porcine renin |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240726
(CHEMBL4093578)Show SMILES CCCOc1ccc(\C=C2/CCn3c2nc2cc(NCCCN(C)C)c(F)cc2c3=O)cc1 Show InChI InChI=1S/C26H31FN4O2/c1-4-14-33-20-8-6-18(7-9-20)15-19-10-13-31-25(19)29-23-17-24(28-11-5-12-30(2)3)22(27)16-21(23)26(31)32/h6-9,15-17,28H,4-5,10-14H2,1-3H3/b19-15+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | 2.06E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to NM23-H2 (unknown origin) by SPR analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240733
(CHEMBL4077352)Show SMILES CCN(CC)CCCNc1cc2nc3\C(CCn3c(=O)c2cc1F)=C\c1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C32H35FN4O2/c1-3-36(4-2)17-8-16-34-30-21-29-27(20-28(30)33)32(38)37-18-15-25(31(37)35-29)19-23-11-13-26(14-12-23)39-22-24-9-6-5-7-10-24/h5-7,9-14,19-21,34H,3-4,8,15-18,22H2,1-2H3/b25-19+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 2.06E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to N-terminal NT-647-NHS labeled NM23-H2 (unknown origin) after 30 mins by MST analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240734
(CHEMBL4076101)Show SMILES CCN(CC)CCCNc1cc2nc3\C(CCn3c(=O)c2cc1F)=C\c1ccc(\C=C\c2ccccn2)cc1 Show InChI InChI=1S/C32H34FN5O/c1-3-37(4-2)18-7-17-35-30-22-29-27(21-28(30)33)32(39)38-19-15-25(31(38)36-29)20-24-11-9-23(10-12-24)13-14-26-8-5-6-16-34-26/h5-6,8-14,16,20-22,35H,3-4,7,15,17-19H2,1-2H3/b14-13+,25-20+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 2.08E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to N-terminal NT-647-NHS labeled NM23-H2 (unknown origin) after 30 mins by MST analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
Nucleoside diphosphate kinase B
(Homo sapiens (Human)) | BDBM50240726
(CHEMBL4093578)Show SMILES CCCOc1ccc(\C=C2/CCn3c2nc2cc(NCCCN(C)C)c(F)cc2c3=O)cc1 Show InChI InChI=1S/C26H31FN4O2/c1-4-14-33-20-8-6-18(7-9-20)15-19-10-13-31-25(19)29-23-17-24(28-11-5-12-30(2)3)22(27)16-21(23)26(31)32/h6-9,15-17,28H,4-5,10-14H2,1-3H3/b19-15+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | 2.10E+4 | n/a | n/a | n/a | n/a | n/a |
Sun Yat-sen University
Curated by ChEMBL
| Assay Description
Binding affinity to N-terminal NT-647-NHS labeled NM23-H2 (unknown origin) after 30 mins by MST analysis |
J Med Chem 60: 6924-6941 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00421
BindingDB Entry DOI: 10.7270/Q2Q242C3 |
More data for this
Ligand-Target Pair | |
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