Found 2 hits in this display 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 |
Calcium-dependent protein kinase 1
(Plasmodium Falciparum) | BDBM36342
(CID24762172 | {4-[2-trans-(4-Amino-cyclohexylamino...)Show SMILES CC(C)(C)c1ccc(cc1)-n1cnc2c(Nc3ccc(cc3)C(=O)N3CCCCC3)nc(N[C@H]3CC[C@H](N)CC3)nc12 |r,wU:33.35,wD:36.39,(6.54,-5.71,;5.21,-6.47,;5.98,-7.8,;3.88,-7.24,;4.44,-5.14,;2.9,-5.14,;2.13,-3.81,;2.9,-2.47,;4.44,-2.47,;5.21,-3.81,;2.13,-1.14,;3.04,.11,;2.13,1.35,;.67,.88,;-.67,1.65,;-.66,3.18,;.67,3.96,;2,3.19,;3.33,3.96,;3.33,5.5,;2,6.27,;.67,5.5,;4.67,6.27,;4.67,7.8,;6.01,5.49,;6,3.96,;7.33,3.19,;8.67,3.96,;8.67,5.5,;7.33,6.27,;-2,.87,;-2,-.66,;-3.33,-1.44,;-4.67,-.66,;-6,-1.43,;-7.34,-.66,;-7.34,.88,;-8.67,1.64,;-6,1.65,;-4.67,.88,;-.66,-1.44,;.67,-.66,)| Show InChI InChI=1S/C33H42N8O/c1-33(2,3)23-9-17-27(18-10-23)41-21-35-28-29(38-32(39-30(28)41)37-26-15-11-24(34)12-16-26)36-25-13-7-22(8-14-25)31(42)40-19-5-4-6-20-40/h7-10,13-14,17-18,21,24,26H,4-6,11-12,15-16,19-20,34H2,1-3H3,(H2,36,37,38,39)/t24-,26- | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 3.49E+3 | n/a | n/a | n/a | n/a | 7.5 | 24 |
The Scripps Research Institute
| Assay Description The test compounds and enzyme were mixed in buffer, and the substrate and [gamma-33P] ATP/ATP were added to the mixture to initiate the reaction. Aft... |
Nat Chem Biol 4: 347-56 (2008)
Article DOI: 10.1038/nchembio.87 BindingDB Entry DOI: 10.7270/Q2TB1573 |
More data for this Ligand-Target Pair | |
Calcium-dependent protein kinase 1
(Plasmodium Falciparum) | BDBM36342
(CID24762172 | {4-[2-trans-(4-Amino-cyclohexylamino...)Show SMILES CC(C)(C)c1ccc(cc1)-n1cnc2c(Nc3ccc(cc3)C(=O)N3CCCCC3)nc(N[C@H]3CC[C@H](N)CC3)nc12 |r,wU:33.35,wD:36.39,(6.54,-5.71,;5.21,-6.47,;5.98,-7.8,;3.88,-7.24,;4.44,-5.14,;2.9,-5.14,;2.13,-3.81,;2.9,-2.47,;4.44,-2.47,;5.21,-3.81,;2.13,-1.14,;3.04,.11,;2.13,1.35,;.67,.88,;-.67,1.65,;-.66,3.18,;.67,3.96,;2,3.19,;3.33,3.96,;3.33,5.5,;2,6.27,;.67,5.5,;4.67,6.27,;4.67,7.8,;6.01,5.49,;6,3.96,;7.33,3.19,;8.67,3.96,;8.67,5.5,;7.33,6.27,;-2,.87,;-2,-.66,;-3.33,-1.44,;-4.67,-.66,;-6,-1.43,;-7.34,-.66,;-7.34,.88,;-8.67,1.64,;-6,1.65,;-4.67,.88,;-.66,-1.44,;.67,-.66,)| Show InChI InChI=1S/C33H42N8O/c1-33(2,3)23-9-17-27(18-10-23)41-21-35-28-29(38-32(39-30(28)41)37-26-15-11-24(34)12-16-26)36-25-13-7-22(8-14-25)31(42)40-19-5-4-6-20-40/h7-10,13-14,17-18,21,24,26H,4-6,11-12,15-16,19-20,34H2,1-3H3,(H2,36,37,38,39)/t24-,26- | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 596 | n/a | n/a | 7.5 | 24 |
The Scripps Research Institute
| Assay Description This parasite proliferation assay, a modification of published DNA intercalating fluorescent dye-based assay, was adapted to 384-well plate format an... |
Nat Chem Biol 4: 347-56 (2008)
Article DOI: 10.1038/nchembio.87 BindingDB Entry DOI: 10.7270/Q2TB1573 |
More data for this Ligand-Target Pair | |