Found 18 hits Enz. Inhib. hit(s) with all data for assayid = 1 entry = 50038180 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 |
|---|
Farnesyl pyrophosphate synthase
(Homo sapiens (Human)) | BDBM50372758
(CHEMBL269960)Show SMILES O=C(Nc1ccc(cc1)C1CCCCC1)C1C(=O)CN(Cc2ccccc2)C1=O Show InChI InChI=1S/C24H26N2O3/c27-21-16-26(15-17-7-3-1-4-8-17)24(29)22(21)23(28)25-20-13-11-19(12-14-20)18-9-5-2-6-10-18/h1,3-4,7-8,11-14,18,22H,2,5-6,9-10,15-16H2,(H,25,28) | 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 | 8.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human FPPS |
Bioorg Med Chem Lett 18: 1840-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.02.009
BindingDB Entry DOI: 10.7270/Q2CF9QZ5 |
More data for this
Ligand-Target Pair | |
Farnesyl pyrophosphate synthase
(Homo sapiens (Human)) | BDBM50372752
(CHEMBL272547)Show SMILES O=C(Nc1ccc(cc1)C1CCCCC1)C1C(=O)CC(Cc2ccccc2)NC1=O Show InChI InChI=1S/C25H28N2O3/c28-22-16-21(15-17-7-3-1-4-8-17)27-25(30)23(22)24(29)26-20-13-11-19(12-14-20)18-9-5-2-6-10-18/h1,3-4,7-8,11-14,18,21,23H,2,5-6,9-10,15-16H2,(H,26,29)(H,27,30) | 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 | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human FPPS |
Bioorg Med Chem Lett 18: 1840-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.02.009
BindingDB Entry DOI: 10.7270/Q2CF9QZ5 |
More data for this
Ligand-Target Pair | |
Farnesyl pyrophosphate synthase
(Homo sapiens (Human)) | BDBM50372753
(CHEMBL271845)Show SMILES O=C(Nc1ccc(cc1)C1CCCCC1)C1C(=O)C[C@@H](NC1=O)c1ccccc1 Show InChI InChI=1S/C24H26N2O3/c27-21-15-20(18-9-5-2-6-10-18)26-24(29)22(21)23(28)25-19-13-11-17(12-14-19)16-7-3-1-4-8-16/h2,5-6,9-14,16,20,22H,1,3-4,7-8,15H2,(H,25,28)(H,26,29)/t20-,22?/m1/s1 | 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 | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human FPPS |
Bioorg Med Chem Lett 18: 1840-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.02.009
BindingDB Entry DOI: 10.7270/Q2CF9QZ5 |
More data for this
Ligand-Target Pair | |
Farnesyl pyrophosphate synthase
(Homo sapiens (Human)) | BDBM50372750
(CHEMBL272914)Show SMILES O=C(Nc1ccc(cc1)N1CCCCC1)C1C(=O)CC(Cc2ccccc2)NC1=O Show InChI InChI=1S/C24H27N3O3/c28-21-16-19(15-17-7-3-1-4-8-17)26-24(30)22(21)23(29)25-18-9-11-20(12-10-18)27-13-5-2-6-14-27/h1,3-4,7-12,19,22H,2,5-6,13-16H2,(H,25,29)(H,26,30) | 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 | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human FPPS |
Bioorg Med Chem Lett 18: 1840-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.02.009
BindingDB Entry DOI: 10.7270/Q2CF9QZ5 |
More data for this
Ligand-Target Pair | |
Farnesyl pyrophosphate synthase
(Homo sapiens (Human)) | BDBM50372751
(CHEMBL256222)Show SMILES O=C(Nc1ccc(Oc2ccccc2)cc1)C1C(=O)CC(Cc2ccccc2)NC1=O Show InChI InChI=1S/C25H22N2O4/c28-22-16-19(15-17-7-3-1-4-8-17)27-25(30)23(22)24(29)26-18-11-13-21(14-12-18)31-20-9-5-2-6-10-20/h1-14,19,23H,15-16H2,(H,26,29)(H,27,30) | 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 | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human FPPS |
Bioorg Med Chem Lett 18: 1840-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.02.009
BindingDB Entry DOI: 10.7270/Q2CF9QZ5 |
More data for this
Ligand-Target Pair | |
Farnesyl pyrophosphate synthase
(Homo sapiens (Human)) | BDBM50372767
(CHEMBL272913)Show SMILES FC(F)(F)c1ccc(NC(=O)C2C(=O)CC(Cc3ccccc3)NC2=O)cn1 Show InChI InChI=1S/C19H16F3N3O3/c20-19(21,22)15-7-6-12(10-23-15)24-17(27)16-14(26)9-13(25-18(16)28)8-11-4-2-1-3-5-11/h1-7,10,13,16H,8-9H2,(H,24,27)(H,25,28) | 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 | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human FPPS |
Bioorg Med Chem Lett 18: 1840-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.02.009
BindingDB Entry DOI: 10.7270/Q2CF9QZ5 |
More data for this
Ligand-Target Pair | |
Farnesyl pyrophosphate synthase
(Homo sapiens (Human)) | BDBM50372766
(CHEMBL271482)Show InChI InChI=1S/C19H24N2O3/c22-16-12-15(11-13-7-3-1-4-8-13)21-19(24)17(16)18(23)20-14-9-5-2-6-10-14/h1,3-4,7-8,14-15,17H,2,5-6,9-12H2,(H,20,23)(H,21,24) | 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 | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human FPPS |
Bioorg Med Chem Lett 18: 1840-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.02.009
BindingDB Entry DOI: 10.7270/Q2CF9QZ5 |
More data for this
Ligand-Target Pair | |
Farnesyl pyrophosphate synthase
(Homo sapiens (Human)) | BDBM50372761
(CHEMBL272163)Show SMILES CC(C)CC1NC(=O)C(C(=O)Nc2ccc(cc2)C2CCCCC2)C1=O Show InChI InChI=1S/C21H28N2O3/c1-13(2)12-17-19(24)18(21(26)23-17)20(25)22-16-10-8-15(9-11-16)14-6-4-3-5-7-14/h8-11,13-14,17-18H,3-7,12H2,1-2H3,(H,22,25)(H,23,26) | 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 | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human FPPS |
Bioorg Med Chem Lett 18: 1840-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.02.009
BindingDB Entry DOI: 10.7270/Q2CF9QZ5 |
More data for this
Ligand-Target Pair | |
Farnesyl pyrophosphate synthase
(Homo sapiens (Human)) | BDBM50372759
(CHEMBL256476)Show SMILES O=C(Nc1ccc(cc1)N1CCCCC1)C1C(=O)NC(CCc2ccccc2)C1=O Show InChI InChI=1S/C24H27N3O3/c28-22-20(14-9-17-7-3-1-4-8-17)26-24(30)21(22)23(29)25-18-10-12-19(13-11-18)27-15-5-2-6-16-27/h1,3-4,7-8,10-13,20-21H,2,5-6,9,14-16H2,(H,25,29)(H,26,30) | 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 | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human FPPS |
Bioorg Med Chem Lett 18: 1840-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.02.009
BindingDB Entry DOI: 10.7270/Q2CF9QZ5 |
More data for this
Ligand-Target Pair | |
Farnesyl pyrophosphate synthase
(Homo sapiens (Human)) | BDBM50372753
(CHEMBL271845)Show SMILES O=C(Nc1ccc(cc1)C1CCCCC1)C1C(=O)C[C@@H](NC1=O)c1ccccc1 Show InChI InChI=1S/C24H26N2O3/c27-21-15-20(18-9-5-2-6-10-18)26-24(29)22(21)23(28)25-19-13-11-17(12-14-19)16-7-3-1-4-8-16/h2,5-6,9-14,16,20,22H,1,3-4,7-8,15H2,(H,25,28)(H,26,29)/t20-,22?/m1/s1 | 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 | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human FPPS |
Bioorg Med Chem Lett 18: 1840-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.02.009
BindingDB Entry DOI: 10.7270/Q2CF9QZ5 |
More data for this
Ligand-Target Pair | |
Farnesyl pyrophosphate synthase
(Homo sapiens (Human)) | BDBM50372755
(CHEMBL255828)Show SMILES O=C(Nc1ccc(cc1)C1CCCCC1)C1C(=O)OC(Cc2ccccc2)C1=O Show InChI InChI=1S/C24H25NO4/c26-22-20(15-16-7-3-1-4-8-16)29-24(28)21(22)23(27)25-19-13-11-18(12-14-19)17-9-5-2-6-10-17/h1,3-4,7-8,11-14,17,20-21H,2,5-6,9-10,15H2,(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 | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human FPPS |
Bioorg Med Chem Lett 18: 1840-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.02.009
BindingDB Entry DOI: 10.7270/Q2CF9QZ5 |
More data for this
Ligand-Target Pair | |
Farnesyl pyrophosphate synthase
(Homo sapiens (Human)) | BDBM50372756
(CHEMBL404337)Show SMILES Clc1cc(Cl)cc(NC(=O)C2C(=O)OC(C2=O)c2ccccc2)c1 Show InChI InChI=1S/C17H11Cl2NO4/c18-10-6-11(19)8-12(7-10)20-16(22)13-14(21)15(24-17(13)23)9-4-2-1-3-5-9/h1-8,13,15H,(H,20,22) | 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 | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human FPPS |
Bioorg Med Chem Lett 18: 1840-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.02.009
BindingDB Entry DOI: 10.7270/Q2CF9QZ5 |
More data for this
Ligand-Target Pair | |
Farnesyl pyrophosphate synthase
(Homo sapiens (Human)) | BDBM50372757
(CHEMBL256033)Show InChI InChI=1S/C17H12ClNO4/c18-11-6-8-12(9-7-11)19-16(21)13-14(20)15(23-17(13)22)10-4-2-1-3-5-10/h1-9,13,15H,(H,19,21) | 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 | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human FPPS |
Bioorg Med Chem Lett 18: 1840-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.02.009
BindingDB Entry DOI: 10.7270/Q2CF9QZ5 |
More data for this
Ligand-Target Pair | |
Farnesyl pyrophosphate synthase
(Homo sapiens (Human)) | BDBM50372763
(CHEMBL272377)Show SMILES O=C(Nc1ccc(cc1)C1CCCCC1)C1C(=O)NC(C1=O)c1ccccc1 Show InChI InChI=1S/C23H24N2O3/c26-21-19(23(28)25-20(21)17-9-5-2-6-10-17)22(27)24-18-13-11-16(12-14-18)15-7-3-1-4-8-15/h2,5-6,9-15,19-20H,1,3-4,7-8H2,(H,24,27)(H,25,28) | 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 | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human FPPS |
Bioorg Med Chem Lett 18: 1840-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.02.009
BindingDB Entry DOI: 10.7270/Q2CF9QZ5 |
More data for this
Ligand-Target Pair | |
Farnesyl pyrophosphate synthase
(Homo sapiens (Human)) | BDBM50372760
(CHEMBL257948)Show SMILES O=C(Nc1ccc(cc1)-c1ccccc1)C1C(=O)NC(CCc2ccccc2)C1=O Show InChI InChI=1S/C25H22N2O3/c28-23-21(16-11-17-7-3-1-4-8-17)27-25(30)22(23)24(29)26-20-14-12-19(13-15-20)18-9-5-2-6-10-18/h1-10,12-15,21-22H,11,16H2,(H,26,29)(H,27,30) | 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 | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human FPPS |
Bioorg Med Chem Lett 18: 1840-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.02.009
BindingDB Entry DOI: 10.7270/Q2CF9QZ5 |
More data for this
Ligand-Target Pair | |
Farnesyl pyrophosphate synthase
(Homo sapiens (Human)) | BDBM50372762
(CHEMBL272162)Show SMILES O=C(Nc1ccc(cc1)C1CCCCC1)C1C(=O)NC(CCc2ccccc2)C1=O Show InChI InChI=1S/C25H28N2O3/c28-23-21(16-11-17-7-3-1-4-8-17)27-25(30)22(23)24(29)26-20-14-12-19(13-15-20)18-9-5-2-6-10-18/h1,3-4,7-8,12-15,18,21-22H,2,5-6,9-11,16H2,(H,26,29)(H,27,30) | 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 | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human FPPS |
Bioorg Med Chem Lett 18: 1840-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.02.009
BindingDB Entry DOI: 10.7270/Q2CF9QZ5 |
More data for this
Ligand-Target Pair | |
Farnesyl pyrophosphate synthase
(Homo sapiens (Human)) | BDBM50372778
(CHEMBL403226)Show SMILES O=C(Nc1ccc(cc1)C1CCCCC1)C1C(=O)NC(Cc2ccccc2)C1=O Show InChI InChI=1S/C24H26N2O3/c27-22-20(15-16-7-3-1-4-8-16)26-24(29)21(22)23(28)25-19-13-11-18(12-14-19)17-9-5-2-6-10-17/h1,3-4,7-8,11-14,17,20-21H,2,5-6,9-10,15H2,(H,25,28)(H,26,29) | 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 | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human FPPS |
Bioorg Med Chem Lett 18: 1840-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.02.009
BindingDB Entry DOI: 10.7270/Q2CF9QZ5 |
More data for this
Ligand-Target Pair | |
Farnesyl pyrophosphate synthase
(Homo sapiens (Human)) | BDBM50372754
(CHEMBL272054)Show SMILES O=C(Nc1ccc(cc1)C1CCCCC1)C1C(=O)C[C@H](NC1=O)c1ccccc1 Show InChI InChI=1S/C24H26N2O3/c27-21-15-20(18-9-5-2-6-10-18)26-24(29)22(21)23(28)25-19-13-11-17(12-14-19)16-7-3-1-4-8-16/h2,5-6,9-14,16,20,22H,1,3-4,7-8,15H2,(H,25,28)(H,26,29)/t20-,22?/m0/s1 | 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 | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human FPPS |
Bioorg Med Chem Lett 18: 1840-4 (2008)
Article DOI: 10.1016/j.bmcl.2008.02.009
BindingDB Entry DOI: 10.7270/Q2CF9QZ5 |
More data for this
Ligand-Target Pair | |
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