BDBM72207 2-[(4-nitrobenzyl)thio]-3-(2-pyridylmethyl)thieno[3,2-d]pyrimidin-4-one::2-[(4-nitrobenzyl)thio]-3-(pyridin-2-ylmethyl)thieno[3,2-d]pyrimidin-4(3H)-one::2-[(4-nitrophenyl)methylsulfanyl]-3-(pyridin-2-ylmethyl)thieno[3,2-d]pyrimidin-4-one::2-[(4-nitrophenyl)methylthio]-3-(2-pyridinylmethyl)-4-thieno[3,2-d]pyrimidinone::MLS000583606::SMR000206792::cid_4374491

SMILES C[C@@H](NC(=O)c1cc(N2CC3CCCC(C2)O3)c(F)cc1NC1CCN(C)CC1)c1cccc(C(F)F)c1F

InChI Key InChIKey=AJDJLUZZXZSLLM-UHFFFAOYSA-N

Data  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 72207   

TargetGTPase KRas [1-169,G12C](Human)
SchroDinger

US Patent
LigandChemical structure of BindingDB Monomer ID 72207BDBM72207(5-(9-oxa-3- azabicyclo[3.3.1]nonan-3- yl)-N-((R)-1...)
Affinity DataIC50: 33.3nMAssay Description:Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Modified NIH3T3, transformed to express firefly...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/15/2026
Entry Details
US Patent