Found 12 hits of ic50 for UniProtKB: P52732 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 |
Kinesin-like protein KIF11 [D130V]
(Homo sapiens (Human)) | BDBM36351
(CID148124 | Docetaxel)Show SMILES [H][C@]12[C@H](OC(=O)c3ccccc3)[C@]3(O)C[C@H](OC(=O)[C@H](O)[C@@H](NC(=O)OC(C)(C)C)c4ccccc4)C(C)=C([C@@H](O)C(=O)[C@]1(C)[C@@H](O)C[C@H]1OC[C@@]21OC(C)=O)C3(C)C |t:39| Show InChI InChI=1S/C43H53NO14/c1-22-26(55-37(51)32(48)30(24-15-11-9-12-16-24)44-38(52)58-39(3,4)5)20-43(53)35(56-36(50)25-17-13-10-14-18-25)33-41(8,34(49)31(47)29(22)40(43,6)7)27(46)19-28-42(33,21-54-28)57-23(2)45/h9-18,26-28,30-33,35,46-48,53H,19-21H2,1-8H3,(H,44,52)/t26-,27-,28+,30-,31+,32+,33-,35-,41+,42-,43+/m0/s1 | PDB MMDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| Purchase
DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Similars
| Article PubMed
| n/a | n/a | 0.200 | n/a | n/a | n/a | n/a | 6.8 | n/a |
GlaxoSmithKline
| Assay Description Cell proliferation assay for ispinesib-resistant DCT116-D130V cell |
Nat Chem Biol 3: 722-6 (2007)
Article DOI: 10.1038/nchembio.2007.34 BindingDB Entry DOI: 10.7270/Q2PK0DHC |
More data for this Ligand-Target Pair | |
Kinesin-like protein KIF11 [D130V]
(Homo sapiens (Human)) | BDBM36351
(CID148124 | Docetaxel)Show SMILES [H][C@]12[C@H](OC(=O)c3ccccc3)[C@]3(O)C[C@H](OC(=O)[C@H](O)[C@@H](NC(=O)OC(C)(C)C)c4ccccc4)C(C)=C([C@@H](O)C(=O)[C@]1(C)[C@@H](O)C[C@H]1OC[C@@]21OC(C)=O)C3(C)C |t:39| Show InChI InChI=1S/C43H53NO14/c1-22-26(55-37(51)32(48)30(24-15-11-9-12-16-24)44-38(52)58-39(3,4)5)20-43(53)35(56-36(50)25-17-13-10-14-18-25)33-41(8,34(49)31(47)29(22)40(43,6)7)27(46)19-28-42(33,21-54-28)57-23(2)45/h9-18,26-28,30-33,35,46-48,53H,19-21H2,1-8H3,(H,44,52)/t26-,27-,28+,30-,31+,32+,33-,35-,41+,42-,43+/m0/s1 | PDB MMDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| Purchase
DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Similars
| Article PubMed
| n/a | n/a | 0.230 | n/a | n/a | n/a | n/a | 6.8 | n/a |
GlaxoSmithKline
| Assay Description Cell proliferation assay for ispinesib-resistant DCT116-D130V cell |
Nat Chem Biol 3: 722-6 (2007)
Article DOI: 10.1038/nchembio.2007.34 BindingDB Entry DOI: 10.7270/Q2PK0DHC |
More data for this Ligand-Target Pair | |
Kinesin-like protein KIF11 [D130V]
(Homo sapiens (Human)) | BDBM36351
(CID148124 | Docetaxel)Show SMILES [H][C@]12[C@H](OC(=O)c3ccccc3)[C@]3(O)C[C@H](OC(=O)[C@H](O)[C@@H](NC(=O)OC(C)(C)C)c4ccccc4)C(C)=C([C@@H](O)C(=O)[C@]1(C)[C@@H](O)C[C@H]1OC[C@@]21OC(C)=O)C3(C)C |t:39| Show InChI InChI=1S/C43H53NO14/c1-22-26(55-37(51)32(48)30(24-15-11-9-12-16-24)44-38(52)58-39(3,4)5)20-43(53)35(56-36(50)25-17-13-10-14-18-25)33-41(8,34(49)31(47)29(22)40(43,6)7)27(46)19-28-42(33,21-54-28)57-23(2)45/h9-18,26-28,30-33,35,46-48,53H,19-21H2,1-8H3,(H,44,52)/t26-,27-,28+,30-,31+,32+,33-,35-,41+,42-,43+/m0/s1 | PDB MMDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| Purchase
DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Similars
| Article PubMed
| n/a | n/a | 0.350 | n/a | n/a | n/a | n/a | 6.8 | n/a |
GlaxoSmithKline
| Assay Description Cell proliferation assay for ispinesib-resistant DCT116-D130V cell |
Nat Chem Biol 3: 722-6 (2007)
Article DOI: 10.1038/nchembio.2007.34 BindingDB Entry DOI: 10.7270/Q2PK0DHC |
More data for this Ligand-Target Pair | |
Kinesin-like protein KIF11 [D130V]
(Homo sapiens (Human)) | BDBM36350
(6-[4-(Trifluoromethyl)phenyl]-3,4-dihydro-2(1H)-qu...)Show InChI InChI=1S/C16H12F3NO/c17-16(18,19)13-5-1-10(2-6-13)11-3-7-14-12(9-11)4-8-15(21)20-14/h1-3,5-7,9H,4,8H2,(H,20,21) | PDB MMDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| Purchase
PC cid PC sid PDB UniChem
| PDB Article PubMed
| n/a | n/a | 0.450 | n/a | n/a | n/a | n/a | 6.8 | n/a |
GlaxoSmithKline
| Assay Description Cell proliferation assay for ispinesib-resistant DCT116-D130V cell |
Nat Chem Biol 3: 722-6 (2007)
Article DOI: 10.1038/nchembio.2007.34 BindingDB Entry DOI: 10.7270/Q2PK0DHC |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Kinesin-like protein KIF11 [D130V]
(Homo sapiens (Human)) | BDBM36351
(CID148124 | Docetaxel)Show SMILES [H][C@]12[C@H](OC(=O)c3ccccc3)[C@]3(O)C[C@H](OC(=O)[C@H](O)[C@@H](NC(=O)OC(C)(C)C)c4ccccc4)C(C)=C([C@@H](O)C(=O)[C@]1(C)[C@@H](O)C[C@H]1OC[C@@]21OC(C)=O)C3(C)C |t:39| Show InChI InChI=1S/C43H53NO14/c1-22-26(55-37(51)32(48)30(24-15-11-9-12-16-24)44-38(52)58-39(3,4)5)20-43(53)35(56-36(50)25-17-13-10-14-18-25)33-41(8,34(49)31(47)29(22)40(43,6)7)27(46)19-28-42(33,21-54-28)57-23(2)45/h9-18,26-28,30-33,35,46-48,53H,19-21H2,1-8H3,(H,44,52)/t26-,27-,28+,30-,31+,32+,33-,35-,41+,42-,43+/m0/s1 | PDB MMDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| Purchase
DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Similars
| Article PubMed
| n/a | n/a | 0.590 | n/a | n/a | n/a | n/a | 6.8 | n/a |
GlaxoSmithKline
| Assay Description Cell proliferation assay for ispinesib-resistant DCT116-D130V cell |
Nat Chem Biol 3: 722-6 (2007)
Article DOI: 10.1038/nchembio.2007.34 BindingDB Entry DOI: 10.7270/Q2PK0DHC |
More data for this Ligand-Target Pair | |
Kinesin-like protein KIF11 [D130V]
(Homo sapiens (Human)) | BDBM36350
(6-[4-(Trifluoromethyl)phenyl]-3,4-dihydro-2(1H)-qu...)Show InChI InChI=1S/C16H12F3NO/c17-16(18,19)13-5-1-10(2-6-13)11-3-7-14-12(9-11)4-8-15(21)20-14/h1-3,5-7,9H,4,8H2,(H,20,21) | PDB MMDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| Purchase
PC cid PC sid PDB UniChem
| PDB Article PubMed
| n/a | n/a | 0.830 | n/a | n/a | n/a | n/a | 6.8 | n/a |
GlaxoSmithKline
| Assay Description Cell proliferation assay for ispinesib-resistant DCT116-D130V cell |
Nat Chem Biol 3: 722-6 (2007)
Article DOI: 10.1038/nchembio.2007.34 BindingDB Entry DOI: 10.7270/Q2PK0DHC |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Kinesin-like protein KIF11 [D130V]
(Homo sapiens (Human)) | BDBM36350
(6-[4-(Trifluoromethyl)phenyl]-3,4-dihydro-2(1H)-qu...)Show InChI InChI=1S/C16H12F3NO/c17-16(18,19)13-5-1-10(2-6-13)11-3-7-14-12(9-11)4-8-15(21)20-14/h1-3,5-7,9H,4,8H2,(H,20,21) | PDB MMDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| Purchase
PC cid PC sid PDB UniChem
| PDB Article PubMed
| n/a | n/a | 3.30 | n/a | n/a | n/a | n/a | 6.8 | n/a |
GlaxoSmithKline
| Assay Description Cell proliferation assay for ispinesib-resistant DCT116-D130V cell |
Nat Chem Biol 3: 722-6 (2007)
Article DOI: 10.1038/nchembio.2007.34 BindingDB Entry DOI: 10.7270/Q2PK0DHC |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Kinesin-like protein KIF11 [D130V]
(Homo sapiens (Human)) | BDBM36350
(6-[4-(Trifluoromethyl)phenyl]-3,4-dihydro-2(1H)-qu...)Show InChI InChI=1S/C16H12F3NO/c17-16(18,19)13-5-1-10(2-6-13)11-3-7-14-12(9-11)4-8-15(21)20-14/h1-3,5-7,9H,4,8H2,(H,20,21) | PDB MMDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| Purchase
PC cid PC sid PDB UniChem
| PDB Article PubMed
| n/a | n/a | 6.90 | n/a | n/a | n/a | n/a | 6.8 | n/a |
GlaxoSmithKline
| Assay Description Cell proliferation assay for ispinesib-resistant DCT116-D130V cell |
Nat Chem Biol 3: 722-6 (2007)
Article DOI: 10.1038/nchembio.2007.34 BindingDB Entry DOI: 10.7270/Q2PK0DHC |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Kinesin-like protein KIF11 [D130V]
(Homo sapiens (Human)) | BDBM50220156
((R)-N-(3-aminopropyl)-N-(1-(3-benzyl-7-chloro-4-ox...)Show SMILES CC(C)[C@@H](N(CCCN)C(=O)c1ccc(C)c(F)c1)c1nc2cc(Cl)ccc2c(=O)n1Cc1ccccc1 Show InChI InChI=1S/C30H32ClFN4O2/c1-19(2)27(35(15-7-14-33)29(37)22-11-10-20(3)25(32)16-22)28-34-26-17-23(31)12-13-24(26)30(38)36(28)18-21-8-5-4-6-9-21/h4-6,8-13,16-17,19,27H,7,14-15,18,33H2,1-3H3/t27-/m1/s1 | PDB MMDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 87.3 | n/a | n/a | n/a | n/a | 6.8 | n/a |
GlaxoSmithKline
| Assay Description Cell proliferation assay for ispinesib-resistant DCT116-D130V cell |
Nat Chem Biol 3: 722-6 (2007)
Article DOI: 10.1038/nchembio.2007.34 BindingDB Entry DOI: 10.7270/Q2PK0DHC |
More data for this Ligand-Target Pair | |
Kinesin-like protein KIF11 [D130V]
(Homo sapiens (Human)) | BDBM50220156
((R)-N-(3-aminopropyl)-N-(1-(3-benzyl-7-chloro-4-ox...)Show SMILES CC(C)[C@@H](N(CCCN)C(=O)c1ccc(C)c(F)c1)c1nc2cc(Cl)ccc2c(=O)n1Cc1ccccc1 Show InChI InChI=1S/C30H32ClFN4O2/c1-19(2)27(35(15-7-14-33)29(37)22-11-10-20(3)25(32)16-22)28-34-26-17-23(31)12-13-24(26)30(38)36(28)18-21-8-5-4-6-9-21/h4-6,8-13,16-17,19,27H,7,14-15,18,33H2,1-3H3/t27-/m1/s1 | PDB MMDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 675 | n/a | n/a | n/a | n/a | 6.8 | n/a |
GlaxoSmithKline
| Assay Description Cell proliferation assay for ispinesib-resistant DCT116-D130V cell |
Nat Chem Biol 3: 722-6 (2007)
Article DOI: 10.1038/nchembio.2007.34 BindingDB Entry DOI: 10.7270/Q2PK0DHC |
More data for this Ligand-Target Pair | |
Kinesin-like protein KIF11 [D130V]
(Homo sapiens (Human)) | BDBM50220156
((R)-N-(3-aminopropyl)-N-(1-(3-benzyl-7-chloro-4-ox...)Show SMILES CC(C)[C@@H](N(CCCN)C(=O)c1ccc(C)c(F)c1)c1nc2cc(Cl)ccc2c(=O)n1Cc1ccccc1 Show InChI InChI=1S/C30H32ClFN4O2/c1-19(2)27(35(15-7-14-33)29(37)22-11-10-20(3)25(32)16-22)28-34-26-17-23(31)12-13-24(26)30(38)36(28)18-21-8-5-4-6-9-21/h4-6,8-13,16-17,19,27H,7,14-15,18,33H2,1-3H3/t27-/m1/s1 | PDB MMDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 903 | n/a | n/a | n/a | n/a | 6.8 | n/a |
GlaxoSmithKline
| Assay Description Cell proliferation assay for ispinesib-resistant DCT116-D130V cell |
Nat Chem Biol 3: 722-6 (2007)
Article DOI: 10.1038/nchembio.2007.34 BindingDB Entry DOI: 10.7270/Q2PK0DHC |
More data for this Ligand-Target Pair | |
Kinesin-like protein KIF11 [D130V]
(Homo sapiens (Human)) | BDBM50220156
((R)-N-(3-aminopropyl)-N-(1-(3-benzyl-7-chloro-4-ox...)Show SMILES CC(C)[C@@H](N(CCCN)C(=O)c1ccc(C)c(F)c1)c1nc2cc(Cl)ccc2c(=O)n1Cc1ccccc1 Show InChI InChI=1S/C30H32ClFN4O2/c1-19(2)27(35(15-7-14-33)29(37)22-11-10-20(3)25(32)16-22)28-34-26-17-23(31)12-13-24(26)30(38)36(28)18-21-8-5-4-6-9-21/h4-6,8-13,16-17,19,27H,7,14-15,18,33H2,1-3H3/t27-/m1/s1 | PDB MMDB
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.19E+3 | n/a | n/a | n/a | n/a | 6.8 | n/a |
GlaxoSmithKline
| Assay Description Cell proliferation assay for ispinesib-resistant DCT116-D130V cell |
Nat Chem Biol 3: 722-6 (2007)
Article DOI: 10.1038/nchembio.2007.34 BindingDB Entry DOI: 10.7270/Q2PK0DHC |
More data for this Ligand-Target Pair | |