Found 4 hits Enz. Inhib. hit(s) with Target = 'Serine/threonine-protein kinase pim-1' and Ligand = 'BDBM377242' 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 |
|---|
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM377242
(N-{4-[(3S,5R)-3-Amino-5-methylpiperidin-1-yl]-7-hy...)Show SMILES C[C@@H]1C[C@H](N)CN(C1)c1c2CC[C@H](O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(OC2CCCOC2)cc1F |r,wU:3.3,1.0,12.13,(-.82,.98,;-2.15,.21,;-3.48,.98,;-4.82,.21,;-6.15,.98,;-4.82,-1.33,;-3.48,-2.1,;-2.15,-1.33,;-3.48,-3.64,;-4.82,-4.41,;-6.28,-3.93,;-7.19,-5.18,;-6.28,-6.42,;-6.68,-7.91,;-4.82,-5.95,;-3.48,-6.72,;-2.15,-5.95,;-2.15,-4.41,;-.82,-3.64,;.52,-4.41,;.52,-5.95,;1.85,-3.64,;3.19,-4.41,;4.52,-3.64,;4.52,-2.1,;5.85,-1.33,;3.19,-1.33,;1.85,-2.1,;3.19,.21,;1.85,.98,;.52,.21,;1.85,2.52,;3.19,3.29,;3.19,4.83,;4.52,5.6,;4.52,7.14,;5.85,7.91,;7.19,7.14,;7.19,5.6,;5.85,4.83,;4.52,2.52,;4.52,.98,;5.85,.21,)| Show InChI InChI=1S/C31H34F3N5O4/c1-16-9-17(35)14-39(13-16)30-20-4-7-26(40)28(20)36-12-25(30)38-31(41)24-6-5-21(32)29(37-24)27-22(33)10-19(11-23(27)34)43-18-3-2-8-42-15-18/h5-6,10-12,16-18,26,40H,2-4,7-9,13-15,35H2,1H3,(H,38,41)/t16-,17+,18?,26+/m1/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | <100 | n/a | n/a | n/a | n/a | n/a | n/a |
Curacyte Chemistry GmbH
| Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b... |
J Med Chem 49: 4116-26 (2006)
BindingDB Entry DOI: 10.7270/Q2FJ2K39 |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM377242
(N-{4-[(3S,5R)-3-Amino-5-methylpiperidin-1-yl]-7-hy...)Show SMILES C[C@@H]1C[C@H](N)CN(C1)c1c2CC[C@H](O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(OC2CCCOC2)cc1F |r,wU:3.3,1.0,12.13,(-.82,.98,;-2.15,.21,;-3.48,.98,;-4.82,.21,;-6.15,.98,;-4.82,-1.33,;-3.48,-2.1,;-2.15,-1.33,;-3.48,-3.64,;-4.82,-4.41,;-6.28,-3.93,;-7.19,-5.18,;-6.28,-6.42,;-6.68,-7.91,;-4.82,-5.95,;-3.48,-6.72,;-2.15,-5.95,;-2.15,-4.41,;-.82,-3.64,;.52,-4.41,;.52,-5.95,;1.85,-3.64,;3.19,-4.41,;4.52,-3.64,;4.52,-2.1,;5.85,-1.33,;3.19,-1.33,;1.85,-2.1,;3.19,.21,;1.85,.98,;.52,.21,;1.85,2.52,;3.19,3.29,;3.19,4.83,;4.52,5.6,;4.52,7.14,;5.85,7.91,;7.19,7.14,;7.19,5.6,;5.85,4.83,;4.52,2.52,;4.52,.98,;5.85,.21,)| Show InChI InChI=1S/C31H34F3N5O4/c1-16-9-17(35)14-39(13-16)30-20-4-7-26(40)28(20)36-12-25(30)38-31(41)24-6-5-21(32)29(37-24)27-22(33)10-19(11-23(27)34)43-18-3-2-8-42-15-18/h5-6,10-12,16-18,26,40H,2-4,7-9,13-15,35H2,1H3,(H,38,41)/t16-,17+,18?,26+/m1/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | <100 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μL compound/DMSO in the assay b... |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2GB2776 |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM377242
(N-{4-[(3S,5R)-3-Amino-5-methylpiperidin-1-yl]-7-hy...)Show SMILES C[C@@H]1C[C@H](N)CN(C1)c1c2CC[C@H](O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(OC2CCCOC2)cc1F |r,wU:3.3,1.0,12.13,(-.82,.98,;-2.15,.21,;-3.48,.98,;-4.82,.21,;-6.15,.98,;-4.82,-1.33,;-3.48,-2.1,;-2.15,-1.33,;-3.48,-3.64,;-4.82,-4.41,;-6.28,-3.93,;-7.19,-5.18,;-6.28,-6.42,;-6.68,-7.91,;-4.82,-5.95,;-3.48,-6.72,;-2.15,-5.95,;-2.15,-4.41,;-.82,-3.64,;.52,-4.41,;.52,-5.95,;1.85,-3.64,;3.19,-4.41,;4.52,-3.64,;4.52,-2.1,;5.85,-1.33,;3.19,-1.33,;1.85,-2.1,;3.19,.21,;1.85,.98,;.52,.21,;1.85,2.52,;3.19,3.29,;3.19,4.83,;4.52,5.6,;4.52,7.14,;5.85,7.91,;7.19,7.14,;7.19,5.6,;5.85,4.83,;4.52,2.52,;4.52,.98,;5.85,.21,)| Show InChI InChI=1S/C31H34F3N5O4/c1-16-9-17(35)14-39(13-16)30-20-4-7-26(40)28(20)36-12-25(30)38-31(41)24-6-5-21(32)29(37-24)27-22(33)10-19(11-23(27)34)43-18-3-2-8-42-15-18/h5-6,10-12,16-18,26,40H,2-4,7-9,13-15,35H2,1H3,(H,38,41)/t16-,17+,18?,26+/m1/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | <100 | n/a | n/a | n/a | n/a | n/a | n/a |
Incyte Corporation; Incyte Holdings Corporation
US Patent
| Assay Description
Pim-1 and Pim-3 kinase assays—20 μL reactions were run in white 384 well polystyrene plates dotted with 0.8 μcompound/DMSO in the assa... |
US Patent US10828290 (2020)
BindingDB Entry DOI: 10.7270/Q2TB19Z5 |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM377242
(N-{4-[(3S,5R)-3-Amino-5-methylpiperidin-1-yl]-7-hy...)Show SMILES C[C@@H]1C[C@H](N)CN(C1)c1c2CC[C@H](O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(OC2CCCOC2)cc1F |r,wU:3.3,1.0,12.13,(-.82,.98,;-2.15,.21,;-3.48,.98,;-4.82,.21,;-6.15,.98,;-4.82,-1.33,;-3.48,-2.1,;-2.15,-1.33,;-3.48,-3.64,;-4.82,-4.41,;-6.28,-3.93,;-7.19,-5.18,;-6.28,-6.42,;-6.68,-7.91,;-4.82,-5.95,;-3.48,-6.72,;-2.15,-5.95,;-2.15,-4.41,;-.82,-3.64,;.52,-4.41,;.52,-5.95,;1.85,-3.64,;3.19,-4.41,;4.52,-3.64,;4.52,-2.1,;5.85,-1.33,;3.19,-1.33,;1.85,-2.1,;3.19,.21,;1.85,.98,;.52,.21,;1.85,2.52,;3.19,3.29,;3.19,4.83,;4.52,5.6,;4.52,7.14,;5.85,7.91,;7.19,7.14,;7.19,5.6,;5.85,4.83,;4.52,2.52,;4.52,.98,;5.85,.21,)| Show InChI InChI=1S/C31H34F3N5O4/c1-16-9-17(35)14-39(13-16)30-20-4-7-26(40)28(20)36-12-25(30)38-31(41)24-6-5-21(32)29(37-24)27-22(33)10-19(11-23(27)34)43-18-3-2-8-42-15-18/h5-6,10-12,16-18,26,40H,2-4,7-9,13-15,35H2,1H3,(H,38,41)/t16-,17+,18?,26+/m1/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | <100 | n/a | n/a | n/a | n/a | n/a | n/a |
Incyte Holdings Corporation; Incyte Corporation
US Patent
| Assay Description
Pim-1 and Pim-3 kinase assays-20 μL reactions were run in white 384 well polystyrene plates dotted with 0.84 compound/DMSO in the assay buffer (... |
US Patent US10517858 (2019)
BindingDB Entry DOI: 10.7270/Q2XD1422 |
More data for this
Ligand-Target Pair | |
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