BDBM72187 7-Bromo-5-pyridin-3-yl-2-thiophen-2-yl-3H-benzo[e][1,2,4]triazepine::7-bromanyl-5-pyridin-3-yl-2-thiophen-2-yl-4H-1,3,4-benzotriazepine::7-bromo-5-(3-pyridinyl)-2-thiophen-2-yl-4H-1,3,4-benzotriazepine::7-bromo-5-(3-pyridyl)-2-(2-thienyl)-4H-1,3,4-benzotriazepine::7-bromo-5-pyridin-3-yl-2-thiophen-2-yl-4H-1,3,4-benzotriazepine::MLS000569094::SMR000172446::cid_1136206

SMILES Brc1ccc2=NC(=NNC(c3cccnc3)=c2c1)c1cccs1

InChI Key InChIKey=CJTFKQKACXOADG-UHFFFAOYSA-N

Data  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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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 = 72187   

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

US Patent
LigandChemical structure of BindingDB Monomer ID 72187BDBM72187(US20250368634, Example 22)
Affinity DataIC50: 20.6nMAssay 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
Target InfoKEGG
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In Depth
Date in BDB:
4/15/2026
Entry Details US Patent