Found 15816 hits with Last Name = 'ino' and Initial = 'm' 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 |
Histone acetyltransferase KAT6B
(Homo sapiens) | BDBM580734
(US11492346, Example 74)Show SMILES COC(=O)c1c(C)cccc1S(=O)(=O)Nc1noc2cc(Cn3cccn3)cc(OC)c12 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| PC cid PC sid UniChem
| US Patent
| 0 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description A. Compound preparation 1. Prepare 10 mM stock solutions in 100% DMSO from solid material 2. Serial dilute 10 mM, 1 mM or 0.1 mM compou... |
Citation and Details
BindingDB Entry DOI: 10.7270/Q23J3HT5 |
More data for this Ligand-Target Pair | |
Histone acetyltransferase KAT7
(Homo sapiens) | BDBM580680
(US11492346, Example 20)Show SMILES COc1cc2CCCCc2cc1S(=O)(=O)Nc1noc2cc(Cn3cccn3)cc(OC)c12 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| PC cid PC sid UniChem
| US Patent
| 0 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description A. Compound preparation 1. Prepare 10 mM stock solutions in 100% DMSO from solid material 2. Serial dilute 10 mM, 1 mM or 0.1 mM compou... |
Citation and Details
BindingDB Entry DOI: 10.7270/Q23J3HT5 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602107
(US11643417, Ex. No. 120)Show SMILES OCC1(O)CCC(CC1)C(F)(F)CN1CCNC(=O)c2oc3ccc(cc3c12)C(F)(F)F |(7.13,.13,;5.59,.13,;4.82,1.46,;6.31,1.86,;3.67,.45,;2.21,.95,;1.91,2.46,;3.07,3.47,;4.53,2.98,;.45,2.96,;-.56,4.12,;.95,4.42,;-.71,1.94,;-2.16,2.44,;-2.35,3.97,;-3.66,4.78,;-5.11,4.26,;-5.61,2.8,;-7.13,2.62,;-4.78,1.51,;-5.4,.1,;-4.26,-.93,;-4.26,-2.47,;-2.92,-3.24,;-1.59,-2.47,;-1.59,-.93,;-2.92,-.16,;-3.25,1.35,;-.26,-3.24,;1.08,-2.47,;-.26,-4.78,;1.08,-4.01,)| | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.00600 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602075
(US11643417, Ex. No. 90)Show SMILES OC[C@@]1(O)CC[C@H](CCN2CCNC(=O)c3oc4ccc(cc4c23)C(F)(F)F)CC1 |r,wU:6.6,2.2,wD:2.1,(7.13,.13,;5.59,.13,;4.82,1.46,;6.16,2.23,;4.53,2.98,;3.07,3.47,;1.91,2.46,;.45,2.96,;-.71,1.94,;-2.16,2.44,;-2.35,3.97,;-3.66,4.78,;-5.11,4.26,;-5.61,2.8,;-7.13,2.62,;-4.78,1.51,;-5.4,.1,;-4.26,-.93,;-4.26,-2.47,;-2.92,-3.24,;-1.59,-2.47,;-1.59,-.93,;-2.92,-.16,;-3.25,1.35,;-.26,-3.24,;1.08,-2.47,;-.26,-4.78,;1.08,-4.01,;2.21,.95,;3.67,.45,)| | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.00900 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602103
(US11643417, Ex. No. 116)Show SMILES OCC1(O)CCC(CCN2CC3(CC3)NC(=O)c3oc4ccc(cc4c23)C(F)(F)F)CC1 |(7.29,1.28,;5.83,1.77,;4.67,.76,;6.13,.26,;3.51,-.25,;2.05,.25,;1.76,1.76,;.3,2.25,;-.86,1.24,;-2.32,1.74,;-2.5,3.27,;-3.81,4.08,;-3.19,5.48,;-4.72,5.32,;-5.26,3.56,;-5.76,2.1,;-7.29,1.92,;-4.93,.8,;-5.56,-.6,;-4.41,-1.63,;-4.41,-3.17,;-3.08,-3.94,;-1.74,-3.17,;-1.74,-1.63,;-3.08,-.86,;-3.4,.64,;-.41,-3.94,;.92,-3.17,;-.41,-5.48,;-.41,-2.4,;2.92,2.77,;4.37,2.27,)| | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.00900 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602160
(US11643417, Ex. No. 156)Show SMILES FC[C@@H]1CO[C@H](CCN2CC3(CC3)NC(=O)c3oc4ccc(cc4c23)C(F)(F)F)CO1 |r| | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602097
(US11643417, Ex. No. 111)Show SMILES OC1(CC1)C1(O)CCC(CCN2CCNC(=O)c3oc4ccc(cc4c23)C(F)(F)F)CC1 |(7.29,1.98,;6.13,.97,;5.63,-.49,;7.14,-.19,;4.67,1.46,;5.44,2.8,;3.51,.45,;2.05,.95,;1.76,2.46,;.3,2.96,;-.86,1.94,;-2.32,2.44,;-2.5,3.97,;-3.81,4.78,;-5.26,4.26,;-5.76,2.8,;-7.29,2.62,;-4.93,1.51,;-5.56,.1,;-4.41,-.93,;-4.41,-2.47,;-3.08,-3.24,;-1.74,-2.47,;-1.74,-.93,;-3.08,-.16,;-3.4,1.35,;-.41,-3.24,;.92,-2.47,;-.41,-4.78,;.92,-4.01,;2.92,3.47,;4.37,2.98,)| | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0110 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602126
(US11643417, Ex. No. 138)Show SMILES OCC1CCC(CC1)C(F)(F)CN1CCNC(=O)c2oc3ccc(cc3c12)C(F)(F)F |(7.29,1.98,;6.13,.97,;4.67,1.46,;3.51,.45,;2.05,.95,;1.76,2.46,;2.92,3.47,;4.37,2.98,;.3,2.96,;0,4.47,;1.46,3.97,;-.86,1.94,;-2.32,2.44,;-2.5,3.97,;-3.81,4.78,;-5.26,4.26,;-5.76,2.8,;-7.29,2.62,;-4.93,1.51,;-5.56,.1,;-4.41,-.93,;-4.41,-2.47,;-3.08,-3.24,;-1.74,-2.47,;-1.74,-.93,;-3.08,-.16,;-3.4,1.35,;-.41,-3.24,;.92,-2.47,;-.41,-4.78,;.92,-4.01,)| | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0150 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM601978
(US11643417, Ex. No. 11 | US11643417, Ex. No. 12 | ...)Show SMILES CC1(O)CCOC(C1)C(F)(F)CN1CCNC(=O)c2oc3ccc(cc3c12)C(F)(F)F | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0170 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602169
(US11643417, Ex. No. 164)Show SMILES OC[C@@H]1CO[C@H](CO1)C(F)(F)CN1CC2(CC2)NC(=O)c2oc3ccc(cc3c12)C(F)(F)F |r| | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0190 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM601981
(US11643417, Ex. No. 13)Show SMILES OCC1(O)CCOC(C1)C(F)(F)CN1CCNC(=O)c2oc3ccc(cc3c12)C(F)(F)F | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0210 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602002
(US11643417, Ex. No. 34)Show SMILES COC1(CO)CCOC(C1)C(F)(F)CN1CCNC(=O)c2oc3ccc(cc3c12)C(F)(F)F | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0210 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602134
(US11643417, Ex. No. 146)Show SMILES OCC1(CO)CCC(CCN2CCNC(=O)c3oc4ccc(cc4c23)C(F)(F)F)CC1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0230 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM601982
(US11643417, Ex. No. 14 | US11643417, Ex. No. 15 | ...)Show SMILES OCC1CCOC(C1)C(F)(F)CN1CCNC(=O)c2oc3ccc(cc3c12)C(F)(F)F | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0250 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM601978
(US11643417, Ex. No. 11 | US11643417, Ex. No. 12 | ...)Show SMILES CC1(O)CCOC(C1)C(F)(F)CN1CCNC(=O)c2oc3ccc(cc3c12)C(F)(F)F | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0280 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602081
(US11643417, Ex. No. 96)Show SMILES OC[C@H]1CO[C@H](CO1)C(F)(F)CN1CCNC(=O)c2oc3ccc(cc3c12)C(F)(F)F |r| | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0280 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM601982
(US11643417, Ex. No. 14 | US11643417, Ex. No. 15 | ...)Show SMILES OCC1CCOC(C1)C(F)(F)CN1CCNC(=O)c2oc3ccc(cc3c12)C(F)(F)F | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0290 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Sigma non-opioid intracellular receptor 1
(Homo sapiens (Human)) | BDBM50146585
(CHEMBL3763396)Show SMILES CC1CCN(CCCCc2cccc3cc(OCCCCCCN4C(=O)c5ccc(cc5C4=O)N(C)C)ccc23)CC1 Show InChI InChI=1S/C36H47N3O3/c1-27-18-22-38(23-19-27)20-8-6-11-28-12-10-13-29-25-31(15-17-32(28)29)42-24-9-5-4-7-21-39-35(40)33-16-14-30(37(2)3)26-34(33)36(39)41/h10,12-17,25-27H,4-9,11,18-24H2,1-3H3 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| | 0.0300 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this Ligand-Target Pair | |
Sigma non-opioid intracellular receptor 1
(Cavia porcellus (Guinea pig)) | BDBM50179280
(1-(4-(6-methoxynaphthalen-1-yl)butyl)-4-methylpipe...)Show InChI InChI=1S/C21H29NO/c1-17-11-14-22(15-12-17)13-4-3-6-18-7-5-8-19-16-20(23-2)9-10-21(18)19/h5,7-10,16-17H,3-4,6,11-15H2,1-2H3 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.0300 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Bari
Curated by ChEMBL
| Assay Description Displacement of [3H](+)-pentazocine from sigma 1 receptor in guinea pig brain membranes |
J Med Chem 48: 8237-44 (2005)
Article DOI: 10.1021/jm050654o BindingDB Entry DOI: 10.7270/Q2MP542J |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602114
(US11643417, Ex. No. 127 | US11643417, Ex. No. 128)Show SMILES CC1(O)CCC(CCN2CC3(CC3)NC(=O)c3oc4ccc(cc4c23)C(F)(F)F)CC1 |(6.41,1.77,;5.25,.76,;6.71,.26,;4.09,-.25,;2.63,.25,;2.34,1.76,;.88,2.25,;-.28,1.24,;-1.74,1.74,;-1.92,3.27,;-3.23,4.08,;-2.61,5.48,;-4.14,5.32,;-4.68,3.56,;-5.18,2.1,;-6.71,1.92,;-4.35,.8,;-4.98,-.6,;-3.83,-1.63,;-3.83,-3.17,;-2.5,-3.94,;-1.16,-3.17,;-1.16,-1.63,;-2.5,-.86,;-2.82,.64,;.17,-3.94,;1.5,-3.17,;.17,-5.48,;.17,-2.4,;3.5,2.77,;4.95,2.27,)| | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0310 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM601982
(US11643417, Ex. No. 14 | US11643417, Ex. No. 15 | ...)Show SMILES OCC1CCOC(C1)C(F)(F)CN1CCNC(=O)c2oc3ccc(cc3c12)C(F)(F)F | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0330 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM601977
(US11643417, Ex. No. 10 | US11643417, Ex. No. 51)Show SMILES OC1CCOC(C1)C(F)(F)CN1CCNC(=O)c2oc3ccc(cc3c12)C(F)(F)F | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0330 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602074
(US11643417, Ex. No. 89)Show SMILES OC[C@]1(O)CCC(CCN2CCNC(=O)c3oc4ccc(cc4c23)C(F)(F)F)CC1 |r,wU:2.1,wD:2.2,(7.13,.13,;5.59,.13,;4.82,1.46,;6.16,2.23,;4.53,2.98,;3.07,3.47,;1.91,2.46,;.45,2.96,;-.71,1.94,;-2.16,2.44,;-2.35,3.97,;-3.66,4.78,;-5.11,4.26,;-5.61,2.8,;-7.13,2.62,;-4.78,1.51,;-5.4,.1,;-4.26,-.93,;-4.26,-2.47,;-2.92,-3.24,;-1.59,-2.47,;-1.59,-.93,;-2.92,-.16,;-3.25,1.35,;-.26,-3.24,;1.08,-2.47,;-.26,-4.78,;1.08,-4.01,;2.21,.95,;3.67,.45,)| | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0330 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602139
(US11643417, Ex. No. 149)Show SMILES O[C@H]1CC[C@@H](CC1)C(F)(F)CN1CC2(CC2)NC(=O)c2oc3ccc(cc3c12)C(F)(F)F |r,wU:4.7,wD:1.0,(6.71,.26,;5.25,.76,;4.95,2.27,;3.5,2.77,;2.34,1.76,;2.63,.25,;4.09,-.25,;.88,2.25,;-.13,3.41,;1.38,3.71,;-.28,1.24,;-1.74,1.74,;-1.92,3.27,;-3.23,4.08,;-2.61,5.48,;-4.14,5.32,;-4.68,3.56,;-5.18,2.1,;-6.71,1.92,;-4.35,.8,;-4.98,-.6,;-3.83,-1.63,;-3.83,-3.17,;-2.5,-3.94,;-1.16,-3.17,;-1.16,-1.63,;-2.5,-.86,;-2.82,.64,;.17,-3.94,;1.5,-3.17,;.17,-5.48,;1.5,-4.71,)| | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0340 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Sigma non-opioid intracellular receptor 1
(Homo sapiens (Human)) | BDBM50145021
(1-Cyclohexyl-4-[4-(1,2,3,4-tetrahydro-naphthalen-1...)Show InChI InChI=1S/C24H38N2/c1-2-13-23(14-3-1)26-19-17-25(18-20-26)16-7-6-10-22-12-8-11-21-9-4-5-15-24(21)22/h4-5,9,15,22-23H,1-3,6-8,10-14,16-20H2 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.0360 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Bari
Curated by ChEMBL
| Assay Description In vitro binding afinity at opioid sigma-1 receptorin guinea pig brain membranes by (+)-[3H]-pentazocine displacement. |
J Med Chem 47: 2308-17 (2004)
Article DOI: 10.1021/jm031026e BindingDB Entry DOI: 10.7270/Q2DN44HS |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602032
(US11643417, Ex. No. 49)Show SMILES CC(C)(O)C1CCOC(C1)C(F)(F)CN1CCNC(=O)c2oc3ccc(cc3c12)C(F)(F)F | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0390 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM601978
(US11643417, Ex. No. 11 | US11643417, Ex. No. 12 | ...)Show SMILES CC1(O)CCOC(C1)C(F)(F)CN1CCNC(=O)c2oc3ccc(cc3c12)C(F)(F)F | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0390 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602044
(US11643417, Ex. No. 61)Show SMILES FC(F)(CN1CCNC(=O)c2oc3ccc(cc3c12)C(F)(F)F)C1CC(=O)CCC1(F)F | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0390 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602092
(US11643417, Ex. No. 106)Show SMILES O[C@H]1CC[C@@H](CC1)C(F)(F)CN1CCNC(=O)c2oc3ccc(cc3c12)C(F)(F)F |r,wU:4.7,wD:1.0,(6.71,.97,;5.25,1.46,;4.95,2.98,;3.5,3.47,;2.34,2.46,;2.63,.95,;4.09,.45,;.88,2.96,;1.38,4.42,;-.13,4.12,;-.28,1.94,;-1.74,2.44,;-1.92,3.97,;-3.23,4.78,;-4.68,4.26,;-5.18,2.8,;-6.71,2.62,;-4.35,1.51,;-4.98,.1,;-3.83,-.93,;-3.83,-2.47,;-2.5,-3.24,;-1.16,-2.47,;-1.16,-.93,;-2.5,-.16,;-2.82,1.35,;.17,-3.24,;1.5,-2.47,;.17,-4.78,;1.5,-4.01,)| | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0410 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM601977
(US11643417, Ex. No. 10 | US11643417, Ex. No. 51)Show SMILES OC1CCOC(C1)C(F)(F)CN1CCNC(=O)c2oc3ccc(cc3c12)C(F)(F)F | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0410 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602062
(US11643417, Ex. No. 77)Show SMILES OC[C@H]1CO[C@@H](CO1)C(F)(F)CN1CCNC(=O)c2oc3ccc(cc3c12)C(F)(F)F |r| | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0440 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
WD repeat-containing protein 5
(Homo sapiens (Human)) | BDBM50520121
(CHEMBL4441671 | US10844044, Example 1)Show SMILES Cc1nc(F)ccc1-c1cc(Cn2ccn(C)c2=N)cc(c1)C(=O)NCc1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C25H22Cl2FN5O/c1-15-20(4-6-23(28)31-15)18-9-17(14-33-8-7-32(2)25(33)29)10-19(12-18)24(34)30-13-16-3-5-21(26)22(27)11-16/h3-12,29H,13-14H2,1-2H3,(H,30,34) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| Purchase
MCE PC cid PC sid PDB UniChem
| PDB Article PubMed
| 0.0440 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Frederick National Laboratory for Cancer Research
Curated by ChEMBL
| Assay Description Competitive inhibition of human N-terminal His6-SUMO tagged WDR5 (22 to 334 residues) expressed in Escherichia coli BL21-Gold(DE3) cells using 10-mer... |
J Med Chem 63: 656-675 (2020)
Article DOI: 10.1021/acs.jmedchem.9b01608 BindingDB Entry DOI: 10.7270/Q2HD801W |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602080
(US11643417, Ex. No. 95)Show SMILES OC[C@@H]1CO[C@H](CO1)C(F)(F)CN1CCNC(=O)c2oc3ccc(cc3c12)C(F)(F)F |r| | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0440 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602168
(US11643417, Ex. No. 163)Show SMILES OCC1(CCC(CCN2CCNC(=O)c3oc4ccc(cc4c23)C(F)(F)F)CC1)C#N |(4.98,-1.15,;5.48,.31,;4.47,1.46,;3.31,.45,;1.85,.95,;1.55,2.46,;.1,2.96,;-1.06,1.94,;-2.52,2.44,;-2.7,3.97,;-4.01,4.78,;-5.46,4.26,;-5.96,2.8,;-7.49,2.62,;-5.13,1.51,;-5.76,.1,;-4.61,-.93,;-4.61,-2.47,;-3.28,-3.24,;-1.95,-2.47,;-1.95,-.93,;-3.28,-.16,;-3.6,1.35,;-.61,-3.24,;.72,-2.47,;-.61,-4.78,;.72,-4.01,;2.71,3.47,;4.17,2.98,;5.98,1.76,;7.49,2.06,)| | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0440 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602040
(US11643417, Ex. No. 57)Show SMILES FC(F)(F)c1ccc2oc3c(N(CC(F)(F)C4CC5(COC5)CCO4)CCNC3=O)c2c1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0450 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602045
(US11643417, Ex. No. 62)Show SMILES OC1CCC(F)(F)C(C1)C(F)(F)CN1CCNC(=O)c2oc3ccc(cc3c12)C(F)(F)F | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0460 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602039
(US11643417, Ex. No. 56 | US11643417, Ex. No. 68 | ...)Show SMILES FC(F)(F)c1ccc2oc3c(N(CC(F)(F)C4COCCO4)CCNC3=O)c2c1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0460 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602114
(US11643417, Ex. No. 127 | US11643417, Ex. No. 128)Show SMILES CC1(O)CCC(CCN2CC3(CC3)NC(=O)c3oc4ccc(cc4c23)C(F)(F)F)CC1 |(6.41,1.77,;5.25,.76,;6.71,.26,;4.09,-.25,;2.63,.25,;2.34,1.76,;.88,2.25,;-.28,1.24,;-1.74,1.74,;-1.92,3.27,;-3.23,4.08,;-2.61,5.48,;-4.14,5.32,;-4.68,3.56,;-5.18,2.1,;-6.71,1.92,;-4.35,.8,;-4.98,-.6,;-3.83,-1.63,;-3.83,-3.17,;-2.5,-3.94,;-1.16,-3.17,;-1.16,-1.63,;-2.5,-.86,;-2.82,.64,;.17,-3.94,;1.5,-3.17,;.17,-5.48,;.17,-2.4,;3.5,2.77,;4.95,2.27,)| | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0530 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602088
(US11643417, Ex. No. 103)Show SMILES FC(F)(F)c1ccc2oc3c(N(CCC4COCCO4)CC4(CC4)NC3=O)c2c1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0580 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM601998
(US11643417, Ex. No. 30)Show SMILES CC(C)(O)C1(O)CCOC(C1)C(F)(F)CN1CCNC(=O)c2oc3ccc(cc3c12)C(F)(F)F | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0580 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602112
(US11643417, Ex. No. 125 | US11643417, Ex. No. 126)Show SMILES OC1CCC(CCN2CC3(CC3)NC(=O)c3oc4ccc(cc4c23)C(F)(F)F)CC1 |(6.71,.26,;5.25,.76,;4.09,-.25,;2.63,.25,;2.34,1.76,;.88,2.25,;-.28,1.24,;-1.74,1.74,;-1.92,3.27,;-3.23,4.08,;-2.61,5.48,;-4.14,5.32,;-4.68,3.56,;-5.18,2.1,;-6.71,1.92,;-4.35,.8,;-4.98,-.6,;-3.83,-1.63,;-3.83,-3.17,;-2.5,-3.94,;-1.16,-3.17,;-1.16,-1.63,;-2.5,-.86,;-2.82,.64,;.17,-3.94,;1.5,-3.17,;.17,-5.48,;.17,-2.4,;3.5,2.77,;4.95,2.27,)| | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0590 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM601978
(US11643417, Ex. No. 11 | US11643417, Ex. No. 12 | ...)Show SMILES CC1(O)CCOC(C1)C(F)(F)CN1CCNC(=O)c2oc3ccc(cc3c12)C(F)(F)F | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0600 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Translocator protein
(Rattus norvegicus (rat)) | BDBM50409614
(CHEMBL5288131)Show SMILES OC(=O)C1CCN(CC1)C1CN(CCC2(CCC(=O)N(CC3CC3)C2)c2ccc(Cl)c(Cl)c2)C1 Show InChI InChI=1S/C26H35Cl2N3O3/c27-22-4-3-20(13-23(22)28)26(8-5-24(32)31(17-26)14-18-1-2-18)9-12-29-15-21(16-29)30-10-6-19(7-11-30)25(33)34/h3-4,13,18-19,21H,1-2,5-12,14-17H2,(H,33,34) | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| | 0.0700 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibitory activity against dihydrofolate reductase (DHFR) from Escherichia coli |
Citation and Details
|
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602029
(US11643417, Ex. No. 46)Show SMILES FC(F)(F)c1ccc2oc3c(N(CC(F)(F)C4CC5(CCO4)OCCO5)CCNC3=O)c2c1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0710 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602039
(US11643417, Ex. No. 56 | US11643417, Ex. No. 68 | ...)Show SMILES FC(F)(F)c1ccc2oc3c(N(CC(F)(F)C4COCCO4)CCNC3=O)c2c1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0720 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602039
(US11643417, Ex. No. 56 | US11643417, Ex. No. 68 | ...)Show SMILES FC(F)(F)c1ccc2oc3c(N(CC(F)(F)C4COCCO4)CCNC3=O)c2c1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0730 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602178
(US11643417, Ex. No. 2-06)Show SMILES C[C@H]1CN(CC[C@H]2CC[C@](O)(CO)CC2)c2c(oc3ccc(cc23)C(F)(F)F)C(=O)N1 |r,wU:6.5,9.9,1.0,wD:9.10,(-3.5,5.55,;-3.66,4.02,;-2.35,3.21,;-2.16,1.68,;-.71,1.18,;.45,2.19,;1.91,1.69,;3.07,2.71,;4.53,2.21,;4.82,.7,;6.16,1.47,;5.59,-.63,;7.13,-.63,;3.67,-.31,;2.21,.18,;-3.25,.58,;-4.78,.74,;-5.4,-.67,;-4.26,-1.7,;-4.26,-3.24,;-2.92,-4.01,;-1.59,-3.24,;-1.59,-1.7,;-2.92,-.93,;-.26,-4.01,;1.08,-3.24,;-.26,-5.55,;1.08,-4.78,;-5.61,2.04,;-7.13,1.85,;-5.11,3.5,)| | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0740 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602084
(US11643417, Ex. No. 110 | US11643417, Ex. No. 99)Show SMILES OC1(CC1)C1CCC(CCN2CCNC(=O)c3oc4ccc(cc4c23)C(F)(F)F)CC1 |(7.29,1.98,;6.13,.97,;5.63,-.49,;7.14,-.19,;4.67,1.46,;3.51,.45,;2.05,.95,;1.76,2.46,;.3,2.96,;-.86,1.94,;-2.32,2.44,;-2.5,3.97,;-3.81,4.78,;-5.26,4.26,;-5.76,2.8,;-7.29,2.62,;-4.93,1.51,;-5.56,.1,;-4.41,-.93,;-4.41,-2.47,;-3.08,-3.24,;-1.74,-2.47,;-1.74,-.93,;-3.08,-.16,;-3.4,1.35,;-.41,-3.24,;.92,-2.47,;-.41,-4.78,;.92,-4.01,;2.92,3.47,;4.37,2.98,)| | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0760 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602001
(US11643417, Ex. No. 33)Show SMILES OCCC1(CCOC(C1)C(F)(F)CN1CCNC(=O)c2oc3ccc(cc3c12)C(F)(F)F)C#N | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0790 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM602093
(US11643417, Ex. No. 107)Show SMILES OC1CCC(CC1)C(F)(F)CN1CCNC(=O)c2oc3ccc(cc3c12)C(F)(F)F |(6.71,.97,;5.25,1.46,;4.09,.45,;2.63,.95,;2.34,2.46,;3.5,3.47,;4.95,2.98,;.88,2.96,;1.38,4.42,;-.13,4.12,;-.28,1.94,;-1.74,2.44,;-1.92,3.97,;-3.23,4.78,;-4.68,4.26,;-5.18,2.8,;-6.71,2.62,;-4.35,1.51,;-4.98,.1,;-3.83,-.93,;-3.83,-2.47,;-2.5,-3.24,;-1.16,-2.47,;-1.16,-.93,;-2.5,-.16,;-2.82,1.35,;.17,-3.24,;1.5,-2.47,;.17,-4.78,;1.5,-4.01,)| | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | 0.0860 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2R49VQ0 |
More data for this Ligand-Target Pair | |