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BDBM481143 US10906896, Cpd 8270

SMILES: CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cncc(c3)-c3nccs3)c2)CC1

InChI Key: InChIKey=CAAAKLVRRGRQHX-UHFFFAOYSA-N

Data: 1 KI  2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 481143   
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
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM481143
PNG
(US10906896, Cpd 8270)
Show SMILES CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cncc(c3)-c3nccs3)c2)CC1
Show InChI InChI=1S/C32H32N8OS/c1-22-3-8-27(36-30(41)24-6-4-23(5-7-24)21-40-14-12-39(2)13-15-40)18-29(22)38-32-35-10-9-28(37-32)25-17-26(20-33-19-25)31-34-11-16-42-31/h3-11,16-20H,12-15,21H2,1-2H3,(H,36,41)(H,35,37,38)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
4.90n/an/an/an/an/an/an/an/a



Inhibikase Therapeutics, Inc.

US Patent


Assay Description
Kinase base buffer (50 mM HEPES, pH 7.5 0.0015% Brij-35; 10 mM MgCl2 2 mM DTT) and Stop buffer, (100 mM HEPES, pH 7.5 0.015% Brij-35; 0.2% Coating Re...


US Patent US10906896 (2021)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))
BDBM481143
PNG
(US10906896, Cpd 8270)
Show SMILES CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cncc(c3)-c3nccs3)c2)CC1
Show InChI InChI=1S/C32H32N8OS/c1-22-3-8-27(36-30(41)24-6-4-23(5-7-24)21-40-14-12-39(2)13-15-40)18-29(22)38-32-35-10-9-28(37-32)25-17-26(20-33-19-25)31-34-11-16-42-31/h3-11,16-20H,12-15,21H2,1-2H3,(H,36,41)(H,35,37,38)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 53n/an/an/an/an/an/a



Inhibikase Therapeutics, Inc.

US Patent


Assay Description
Kinase base buffer (50 mM HEPES, pH 7.5 0.0015% Brij-35; 10 mM MgCl2 2 mM DTT) and Stop buffer, (100 mM HEPES, pH 7.5 0.015% Brij-35; 0.2% Coating Re...


US Patent US10906896 (2021)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL2


(Homo sapiens (Human))
BDBM481143
PNG
(US10906896, Cpd 8270)
Show SMILES CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cncc(c3)-c3nccs3)c2)CC1
Show InChI InChI=1S/C32H32N8OS/c1-22-3-8-27(36-30(41)24-6-4-23(5-7-24)21-40-14-12-39(2)13-15-40)18-29(22)38-32-35-10-9-28(37-32)25-17-26(20-33-19-25)31-34-11-16-42-31/h3-11,16-20H,12-15,21H2,1-2H3,(H,36,41)(H,35,37,38)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 100n/an/an/an/an/an/a



Inhibikase Therapeutics, Inc.

US Patent


Assay Description
Kinase base buffer (50 mM HEPES, pH 7.5 0.0015% Brij-35; 10 mM MgCl2 2 mM DTT) and Stop buffer, (100 mM HEPES, pH 7.5 0.015% Brij-35; 0.2% Coating Re...


US Patent US10906896 (2021)

More data for this
Ligand-Target Pair