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BDBM481127 US10906896, Cpd 806

SMILES: Cc1cc(on1)-c1cncc(c1)-c1ccnc(Nc2cc(NC(=O)c3ccc(CN4CCNCC4)cc3)ccc2C)n1

InChI Key: InChIKey=OGFUMLMDBRBYKQ-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 = 481127   
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))
BDBM481127
PNG
(US10906896, Cpd 806)
Show SMILES Cc1cc(on1)-c1cncc(c1)-c1ccnc(Nc2cc(NC(=O)c3ccc(CN4CCNCC4)cc3)ccc2C)n1
Show InChI InChI=1S/C32H32N8O2/c1-21-3-8-27(36-31(41)24-6-4-23(5-7-24)20-40-13-11-33-12-14-40)17-29(21)38-32-35-10-9-28(37-32)25-16-26(19-34-18-25)30-15-22(2)39-42-30/h3-10,15-19,33H,11-14,20H2,1-2H3,(H,36,41)(H,35,37,38)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
13n/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))
BDBM481127
PNG
(US10906896, Cpd 806)
Show SMILES Cc1cc(on1)-c1cncc(c1)-c1ccnc(Nc2cc(NC(=O)c3ccc(CN4CCNCC4)cc3)ccc2C)n1
Show InChI InChI=1S/C32H32N8O2/c1-21-3-8-27(36-31(41)24-6-4-23(5-7-24)20-40-13-11-33-12-14-40)17-29(21)38-32-35-10-9-28(37-32)25-16-26(19-34-18-25)30-15-22(2)39-42-30/h3-10,15-19,33H,11-14,20H2,1-2H3,(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 84n/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))
BDBM481127
PNG
(US10906896, Cpd 806)
Show SMILES Cc1cc(on1)-c1cncc(c1)-c1ccnc(Nc2cc(NC(=O)c3ccc(CN4CCNCC4)cc3)ccc2C)n1
Show InChI InChI=1S/C32H32N8O2/c1-21-3-8-27(36-31(41)24-6-4-23(5-7-24)20-40-13-11-33-12-14-40)17-29(21)38-32-35-10-9-28(37-32)25-16-26(19-34-18-25)30-15-22(2)39-42-30/h3-10,15-19,33H,11-14,20H2,1-2H3,(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 152n/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