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2 similar compounds to monomer 50031910

Compile data set for download or QSAR
Wt: 356.8
BDBM50043700
Wt: 606.6
BDBM50031907
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50043700,50031907   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Tyrosine-protein phosphatase non-receptor type 22


(Homo sapiens (Human))
BDBM50031907
PNG
(CHEMBL2337245)
Show SMILES Cc1ccc(o1)-c1cc(C(=O)NCc2cccc(CNC(=O)c3cc(nc4ccccc34)-c3ccc(C)o3)c2)c2ccccc2n1
Show InChI InChI=1S/C38H30N4O4/c1-23-14-16-35(45-23)33-19-29(27-10-3-5-12-31(27)41-33)37(43)39-21-25-8-7-9-26(18-25)22-40-38(44)30-20-34(36-17-15-24(2)46-36)42-32-13-6-4-11-28(30)32/h3-20H,21-22H2,1-2H3,(H,39,43)(H,40,44)
PDB

UniProtKB/SwissProt

GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
1.79E+4n/an/an/an/an/an/an/an/a



Shandong University

Curated by ChEMBL


Assay Description
Competitive inhibition of N-terminal His-tagged Lyp (unknown origin) catalytic domain (1 to 294 residues) expressed in Escherichia coli BL21 (DE3) as...


J Med Chem 57: 9309-22 (2014)


Article DOI: 10.1021/jm500692u
BindingDB Entry DOI: 10.7270/Q2ZG6TVJ
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PIM


(Homo sapiens (Human))
BDBM50043700
PNG
(CHEMBL3355560 | US10047093, 8-62 | US9416132, 8-62)
Show SMILES C[C@]1(O)CC[C@@H](CC1)Nc1ccn2ncc(-c3cccc(Cl)c3)c2n1
Show InChI InChI=1S/C19H21ClN4O/c1-19(25)8-5-15(6-9-19)22-17-7-10-24-18(23-17)16(12-21-24)13-3-2-4-14(20)11-13/h2-4,7,10-12,15,25H,5-6,8-9H2,1H3,(H,22,23)/t15-,19-
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 378n/an/an/an/an/a25



TOLERO PHARMACEUTICALS, INC.

US Patent


Assay Description
One illustrative manner in which Pim-1 kinase activity can be determined is by quantifying the amount of ATP remaining in solution after an in vitro ...


US Patent US10047093 (2018)

More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PIM


(Homo sapiens (Human))
BDBM50043700
PNG
(CHEMBL3355560 | US10047093, 8-62 | US9416132, 8-62)
Show SMILES C[C@]1(O)CC[C@@H](CC1)Nc1ccn2ncc(-c3cccc(Cl)c3)c2n1
Show InChI InChI=1S/C19H21ClN4O/c1-19(25)8-5-15(6-9-19)22-17-7-10-24-18(23-17)16(12-21-24)13-3-2-4-14(20)11-13/h2-4,7,10-12,15,25H,5-6,8-9H2,1H3,(H,22,23)/t15-,19-
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 378n/an/an/an/an/an/a



Astex Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pim1 (unknown origin) using luciferase-luciferin based ATP detection reagent by Kinase-Glo assay


ACS Med Chem Lett 6: 63-7 (2015)


Article DOI: 10.1021/ml500300c
BindingDB Entry DOI: 10.7270/Q2J67JHN
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PIM


(Homo sapiens (Human))
BDBM50043700
PNG
(CHEMBL3355560 | US10047093, 8-62 | US9416132, 8-62)
Show SMILES C[C@]1(O)CC[C@@H](CC1)Nc1ccn2ncc(-c3cccc(Cl)c3)c2n1
Show InChI InChI=1S/C19H21ClN4O/c1-19(25)8-5-15(6-9-19)22-17-7-10-24-18(23-17)16(12-21-24)13-3-2-4-14(20)11-13/h2-4,7,10-12,15,25H,5-6,8-9H2,1H3,(H,22,23)/t15-,19-
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 378n/an/an/an/an/a25



Tolero Pharmaceuticals, Inc.

US Patent


Assay Description
These assays are set up in duplicate 50 ul volumes in white, flat bottom 96 well plates. Inhibitors are added to the solution of 1× kinase buff...


US Patent US9416132 (2016)


BindingDB Entry DOI: 10.7270/Q2CV4GNG
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase pim-2


(Homo sapiens (Human))
BDBM50043700
PNG
(CHEMBL3355560 | US10047093, 8-62 | US9416132, 8-62)
Show SMILES C[C@]1(O)CC[C@@H](CC1)Nc1ccn2ncc(-c3cccc(Cl)c3)c2n1
Show InChI InChI=1S/C19H21ClN4O/c1-19(25)8-5-15(6-9-19)22-17-7-10-24-18(23-17)16(12-21-24)13-3-2-4-14(20)11-13/h2-4,7,10-12,15,25H,5-6,8-9H2,1H3,(H,22,23)/t15-,19-
PDB
MMDB

KEGG

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.26E+3n/an/an/an/an/an/a



Astex Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pim2 (unknown origin) using luciferase-luciferin based ATP detection reagent by Kinase-Glo assay


ACS Med Chem Lett 6: 63-7 (2015)


Article DOI: 10.1021/ml500300c
BindingDB Entry DOI: 10.7270/Q2J67JHN
More data for this
Ligand-Target Pair