Found 13 hits with Last Name = 'valentijn' and Initial = 'ar' 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 |
Asialoglycoprotein receptor 1
(Mus musculus) | BDBM50074090
(CHEMBL2368210 | Galactoside analogue)Show SMILES OC[C@@H]1O[C@@H](OCCCCC(=O)NCCCNC(=O)CCOCC(COCCC(=O)NCCCNC(=O)CCCCO[C@@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]2O)(COCCC(=O)NCCCNC(=O)CCCCO[C@@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]2O)NC(=O)CNC(=O)OCc2ccccc2)[C@@H](O)[C@@H](O)[C@H]1O Show InChI InChI=1S/C65H110N8O30/c74-34-42-52(84)55(87)58(90)61(101-42)97-27-7-4-15-45(77)66-21-10-24-69-48(80)18-30-94-38-65(73-51(83)33-72-64(93)100-37-41-13-2-1-3-14-41,39-95-31-19-49(81)70-25-11-22-67-46(78)16-5-8-28-98-62-59(91)56(88)53(85)43(35-75)102-62)40-96-32-20-50(82)71-26-12-23-68-47(79)17-6-9-29-99-63-60(92)57(89)54(86)44(36-76)103-63/h1-3,13-14,42-44,52-63,74-76,84-92H,4-12,15-40H2,(H,66,77)(H,67,78)(H,68,79)(H,69,80)(H,70,81)(H,71,82)(H,72,93)(H,73,83)/t42?,43?,44?,52-,53-,54-,55?,56?,57?,58?,59?,60?,61?,62?,63?,65?/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 93 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Leiden University
Curated by ChEMBL
| Assay Description Affinity tested by in vitro competition assay of [125I]ASOR binding to parenchymal rat liver cells |
J Med Chem 42: 609-18 (1999)
Article DOI: 10.1021/jm981078h BindingDB Entry DOI: 10.7270/Q2BR8RCC |
More data for this Ligand-Target Pair | |
Asialoglycoprotein receptor 1
(Mus musculus) | BDBM50074091
(CHEMBL2368208 | Galactoside analogue)Show SMILES OC[C@@H]1O[C@@H](OCCCCC(=O)NCC(=O)NCCCC(=O)OCC(COC(=O)CCCNC(=O)CNC(=O)CCCCO[C@@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]2O)(COC(=O)CCCNC(=O)CNC(=O)CCCCO[C@@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]2O)NC(=O)CNC(=O)OCc2ccccc2)[C@@H](O)[C@@H](O)[C@H]1O Show InChI InChI=1S/C65H104N8O33/c74-31-39-52(87)55(90)58(93)61(104-39)97-24-7-4-15-42(77)69-27-45(80)66-21-10-18-49(84)101-35-65(73-48(83)30-72-64(96)100-34-38-13-2-1-3-14-38,36-102-50(85)19-11-22-67-46(81)28-70-43(78)16-5-8-25-98-62-59(94)56(91)53(88)40(32-75)105-62)37-103-51(86)20-12-23-68-47(82)29-71-44(79)17-6-9-26-99-63-60(95)57(92)54(89)41(33-76)106-63/h1-3,13-14,39-41,52-63,74-76,87-95H,4-12,15-37H2,(H,66,80)(H,67,81)(H,68,82)(H,69,77)(H,70,78)(H,71,79)(H,72,96)(H,73,83)/t39?,40?,41?,52-,53-,54-,55?,56?,57?,58?,59?,60?,61?,62?,63?,65?/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 93 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Leiden University
Curated by ChEMBL
| Assay Description Affinity tested by in vitro competition assay of [125I]ASOR binding to parenchymal rat liver cells |
J Med Chem 42: 609-18 (1999)
Article DOI: 10.1021/jm981078h BindingDB Entry DOI: 10.7270/Q2BR8RCC |
More data for this Ligand-Target Pair | |
Asialoglycoprotein receptor 1
(Mus musculus) | BDBM50074089
(CHEMBL2368207 | TG(20)C-Galactoside analogue)Show SMILES [H][C@@]12CC[C@H](C(C)CCCC(C)C)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@H](CC[C@]12C)OC(=O)CNC(=O)CCCCC(=O)NCC(=O)NC(COCOCCOCCOCCOCCO[C@@H]1O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]1O)(COCOCCOCCOCCOCCO[C@@H]1O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]1O)COCOCCOCCOCCOCCO[C@@H]1O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]1O |t:24| Show InChI InChI=1S/C86H153N3O38/c1-57(2)9-8-10-58(3)62-15-16-63-61-14-13-59-45-60(17-19-84(59,4)64(61)18-20-85(62,63)5)124-71(96)47-88-69(94)12-7-6-11-68(93)87-46-70(95)89-86(51-118-54-115-36-33-109-24-21-106-27-30-112-39-42-121-81-78(103)75(100)72(97)65(48-90)125-81,52-119-55-116-37-34-110-25-22-107-28-31-113-40-43-122-82-79(104)76(101)73(98)66(49-91)126-82)53-120-56-117-38-35-111-26-23-108-29-32-114-41-44-123-83-80(105)77(102)74(99)67(50-92)127-83/h13,57-58,60-67,72-83,90-92,97-105H,6-12,14-56H2,1-5H3,(H,87,93)(H,88,94)(H,89,95)/t58?,60-,61?,62+,63?,64?,65?,66?,67?,72+,73+,74+,75?,76?,77?,78?,79?,80?,81?,82?,83?,84-,85+,86?/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 200 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Leiden University
Curated by ChEMBL
| Assay Description Affinity tested by in vitro competition assay of [125I]ASOR binding to parenchymal rat liver cells |
J Med Chem 42: 609-18 (1999)
Article DOI: 10.1021/jm981078h BindingDB Entry DOI: 10.7270/Q2BR8RCC |
More data for this Ligand-Target Pair | |
Squalene synthase
(Homo sapiens (Human)) | BDBM50290252
(CHEMBL78510 | potassium; (3E,7E)-4,8,12-trimethyl-...)Show SMILES [#6]-[#6](-[#6]-[#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](/[#6])-[#6])-[#6]\[#6]=[#6](/P([#8-])([#8-])=O)P([#8-])([#8-])=O Show InChI InChI=1S/C16H30O6P2/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-16(23(17,18)19)24(20,21)22/h7,9,12,15H,5-6,8,10-11H2,1-4H3,(H2,17,18,19)(H2,20,21,22)/p-4/b14-9+ | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article
| n/a | n/a | 18 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Inhibition of Squalene Synthase |
Bioorg Med Chem Lett 7: 2435-2440 (1997)
Article DOI: 10.1016/S0960-894X(97)00448-4 BindingDB Entry DOI: 10.7270/Q2SN08Z5 |
More data for this Ligand-Target Pair | |
Squalene synthase
(Homo sapiens (Human)) | BDBM50290254
(CHEMBL80021 | pentapotassium ({[(3E,7E)-4,8,12-tri...)Show SMILES [#6]-[#6](-[#6]-[#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](/[#6])-[#6])-[#6]-[#6]=[#6](P([#8-])([#8-])=O)P([#8-])(=O)[#6]P([#8-])([#8-])=O |w:14.13| Show InChI InChI=1S/C17H33O8P3/c1-14(2)7-5-8-15(3)9-6-10-16(4)11-12-17(28(23,24)25)26(18,19)13-27(20,21)22/h7,9,12,16H,5-6,8,10-11,13H2,1-4H3,(H,18,19)(H2,20,21,22)(H2,23,24,25)/p-5/b15-9+,17-12? | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article
| n/a | n/a | 1.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Inhibition of Squalene Synthase |
Bioorg Med Chem Lett 7: 2435-2440 (1997)
Article DOI: 10.1016/S0960-894X(97)00448-4 BindingDB Entry DOI: 10.7270/Q2SN08Z5 |
More data for this Ligand-Target Pair | |
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM50290254
(CHEMBL80021 | pentapotassium ({[(3E,7E)-4,8,12-tri...)Show SMILES [#6]-[#6](-[#6]-[#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](/[#6])-[#6])-[#6]-[#6]=[#6](P([#8-])([#8-])=O)P([#8-])(=O)[#6]P([#8-])([#8-])=O |w:14.13| Show InChI InChI=1S/C17H33O8P3/c1-14(2)7-5-8-15(3)9-6-10-16(4)11-12-17(28(23,24)25)26(18,19)13-27(20,21)22/h7,9,12,16H,5-6,8,10-11,13H2,1-4H3,(H,18,19)(H2,20,21,22)(H2,23,24,25)/p-5/b15-9+,17-12? | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article
| n/a | n/a | 1.81E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Inhibition of Farnesyl Transferase |
Bioorg Med Chem Lett 7: 2435-2440 (1997)
Article DOI: 10.1016/S0960-894X(97)00448-4 BindingDB Entry DOI: 10.7270/Q2SN08Z5 |
More data for this Ligand-Target Pair | |
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM50290253
(CHEMBL21986 | pentapotassium ({[(6E,10E,15E,19E)-2...)Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]C([#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](/[#6])-[#6])(P([#8-])([#8-])=O)P([#8-])(=O)[#6]P([#8-])([#8-])=O Show InChI InChI=1S/C32H57O8P3/c1-26(2)13-9-15-28(5)17-11-19-30(7)21-23-32(43(38,39)40,41(33,34)25-42(35,36)37)24-22-31(8)20-12-18-29(6)16-10-14-27(3)4/h13-14,17-18,21-22H,9-12,15-16,19-20,23-25H2,1-8H3,(H,33,34)(H2,35,36,37)(H2,38,39,40)/p-5/b28-17+,29-18+,30-21+,31-22+ | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article
| n/a | n/a | 3.99E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Inhibition of Farnesyl Transferase |
Bioorg Med Chem Lett 7: 2435-2440 (1997)
Article DOI: 10.1016/S0960-894X(97)00448-4 BindingDB Entry DOI: 10.7270/Q2SN08Z5 |
More data for this Ligand-Target Pair | |
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM50290252
(CHEMBL78510 | potassium; (3E,7E)-4,8,12-trimethyl-...)Show SMILES [#6]-[#6](-[#6]-[#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](/[#6])-[#6])-[#6]\[#6]=[#6](/P([#8-])([#8-])=O)P([#8-])([#8-])=O Show InChI InChI=1S/C16H30O6P2/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-16(23(17,18)19)24(20,21)22/h7,9,12,15H,5-6,8,10-11H2,1-4H3,(H2,17,18,19)(H2,20,21,22)/p-4/b14-9+ | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article
| n/a | n/a | 1.35E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Inhibition of Farnesyl Transferase |
Bioorg Med Chem Lett 7: 2435-2440 (1997)
Article DOI: 10.1016/S0960-894X(97)00448-4 BindingDB Entry DOI: 10.7270/Q2SN08Z5 |
More data for this Ligand-Target Pair | |
Squalene synthase
(Homo sapiens (Human)) | BDBM50290253
(CHEMBL21986 | pentapotassium ({[(6E,10E,15E,19E)-2...)Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]C([#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](/[#6])-[#6])(P([#8-])([#8-])=O)P([#8-])(=O)[#6]P([#8-])([#8-])=O Show InChI InChI=1S/C32H57O8P3/c1-26(2)13-9-15-28(5)17-11-19-30(7)21-23-32(43(38,39)40,41(33,34)25-42(35,36)37)24-22-31(8)20-12-18-29(6)16-10-14-27(3)4/h13-14,17-18,21-22H,9-12,15-16,19-20,23-25H2,1-8H3,(H,33,34)(H2,35,36,37)(H2,38,39,40)/p-5/b28-17+,29-18+,30-21+,31-22+ | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article
| n/a | n/a | 2.33E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Inhibition of Squalene Synthase |
Bioorg Med Chem Lett 7: 2435-2440 (1997)
Article DOI: 10.1016/S0960-894X(97)00448-4 BindingDB Entry DOI: 10.7270/Q2SN08Z5 |
More data for this Ligand-Target Pair | |
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM50290251
(CHEMBL79827 | tripotassium 2,4,6-trioxo-3-[(2E,6E)...)Show SMILES [#6]-[#6](-[#6]-[#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](\[#6])-[#6])-[#6]-[#6]=[#6]1P([#8-])(=O)[#8]P([#8-])(=O)[#6]=P1([#8])[#8-] |w:14.13| Show InChI InChI=1S/C17H30O7P3/c1-14(2)7-5-8-15(3)9-6-10-16(4)11-12-17-25(18,19)13-26(20,21)24-27(17,22)23/h7,9,12-13,16H,5-6,8,10-11H2,1-4H3,(H3-,18,19,20,21,22,23)/q-1/p-2/b15-9+,17-12? | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article
| n/a | n/a | 3.42E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Inhibition of Farnesyl Transferase |
Bioorg Med Chem Lett 7: 2435-2440 (1997)
Article DOI: 10.1016/S0960-894X(97)00448-4 BindingDB Entry DOI: 10.7270/Q2SN08Z5 |
More data for this Ligand-Target Pair | |
Squalene synthase
(Homo sapiens (Human)) | BDBM50290251
(CHEMBL79827 | tripotassium 2,4,6-trioxo-3-[(2E,6E)...)Show SMILES [#6]-[#6](-[#6]-[#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](\[#6])-[#6])-[#6]-[#6]=[#6]1P([#8-])(=O)[#8]P([#8-])(=O)[#6]=P1([#8])[#8-] |w:14.13| Show InChI InChI=1S/C17H30O7P3/c1-14(2)7-5-8-15(3)9-6-10-16(4)11-12-17-25(18,19)13-26(20,21)24-27(17,22)23/h7,9,12-13,16H,5-6,8,10-11H2,1-4H3,(H3-,18,19,20,21,22,23)/q-1/p-2/b15-9+,17-12? | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article
| n/a | n/a | 4.64E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Inhibition of Squalene Synthase |
Bioorg Med Chem Lett 7: 2435-2440 (1997)
Article DOI: 10.1016/S0960-894X(97)00448-4 BindingDB Entry DOI: 10.7270/Q2SN08Z5 |
More data for this Ligand-Target Pair | |
Squalene synthase
(Homo sapiens (Human)) | BDBM50290250
(CHEMBL81657 | tripotassium 2,4,6-trioxo-3,3-bis[(2...)Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]C1([#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](\[#6])-[#6])P([#8-])(=O)[#8]P([#8-])(=O)[#6]=P1([#8])[#8-] Show InChI InChI=1S/C32H54O7P3/c1-26(2)13-9-15-28(5)17-11-19-30(7)21-23-32(40(33,34)25-41(35,36)39-42(32,37)38)24-22-31(8)20-12-18-29(6)16-10-14-27(3)4/h13-14,17-18,21-22,25H,9-12,15-16,19-20,23-24H2,1-8H3,(H3-,33,34,35,36,37,38)/q-1/p-2/b28-17+,29-18+,30-21+,31-22+ | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article
| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Inhibition of Squalene Synthase |
Bioorg Med Chem Lett 7: 2435-2440 (1997)
Article DOI: 10.1016/S0960-894X(97)00448-4 BindingDB Entry DOI: 10.7270/Q2SN08Z5 |
More data for this Ligand-Target Pair | |
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha
(Homo sapiens (Human)) | BDBM50290250
(CHEMBL81657 | tripotassium 2,4,6-trioxo-3,3-bis[(2...)Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]C1([#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](\[#6])-[#6])P([#8-])(=O)[#8]P([#8-])(=O)[#6]=P1([#8])[#8-] Show InChI InChI=1S/C32H54O7P3/c1-26(2)13-9-15-28(5)17-11-19-30(7)21-23-32(40(33,34)25-41(35,36)39-42(32,37)38)24-22-31(8)20-12-18-29(6)16-10-14-27(3)4/h13-14,17-18,21-22,25H,9-12,15-16,19-20,23-24H2,1-8H3,(H3-,33,34,35,36,37,38)/q-1/p-2/b28-17+,29-18+,30-21+,31-22+ | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article
| n/a | n/a | 5.62E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description Inhibition of Farnesyl Transferase |
Bioorg Med Chem Lett 7: 2435-2440 (1997)
Article DOI: 10.1016/S0960-894X(97)00448-4 BindingDB Entry DOI: 10.7270/Q2SN08Z5 |
More data for this Ligand-Target Pair | |