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SMILES: CN1CCC[C@H]1COc1nc(N2CCN(C)CC2)c2cnc(c(F)c2n1)-c1cc(O)cc2ccccc12

InChI Key:

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50585382   
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
GTPase KRas


(Homo sapiens (Human))		BDBM50585382
PNG
(CHEMBL5085395)
Show SMILES CN1CCC[C@H]1COc1nc(N2CCN(C)CC2)c2cnc(c(F)c2n1)-c1cc(O)cc2ccccc12 |r|
PDB
MMDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 6.20E+3n/an/an/an/an/a


TBA

Assay Description
Binding affinity to human AviTEV6His-tagged KRAS isoform 4B wild type (1 to 169 residues) expressed in Escherichia coli BL21 (DE3) assessed as dissoc...

Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01688
BindingDB Entry DOI: 10.7270/Q2TM7G15
More data for this
Ligand-Target Pair