Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL26103038

COc1cc2c(-c3ccc(NC(=O)Cc4ccc(C(F)(F)F)cc4)cc3)ncnc2cc1OCC1CCNCC1.O=C(O)C(F)(F)F

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KIT P10721 5/20 0.45
▸ KDR P35968 6/20 0.44
▸ FLT4 P35916 5/20 0.44
▸ EGFR P00533 5/20 0.44
▸ FGFR1 P11362 4/20 0.44
▸ FLT1 P17948 4/20 0.44
▸ AXL P30530 1/20 0.43
▸ TYRO3 Q06418 1/20 0.43
▸ MERTK Q12866 1/20 0.43
▸ RAF1 P04049 2/20 0.43
▸ AURKA O14965 1/20 0.42
▸ AURKB Q96GD4 1/20 0.42
▸ PDGFRB P09619 2/20 0.42
▸ BRAF P15056 2/20 0.42
▸ HDAC1 Q13547 1/20 0.41
▸ CSF1R P07333 1/20 0.41
▸ RET P07949 1/20 0.41
▸ PDGFRA P16234 1/20 0.41
▸ DDR1 Q08345 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Trifluoroacetic Acid SCHEMBL30394834 1.00 KIT (0.45) KITKDRFLT4EGFRFGFR1
SCHEMBL26536043 0.97 KDR (0.46) KITKDRFLT4EGFRFGFR1
SCHEMBL30891790 0.97 KDR (0.46) KITKDRFLT4EGFRFGFR1
SCHEMBL26102350 0.97 KDR (0.46) KITKDRFLT4EGFRFGFR1
SCHEMBL30891758 0.93 KIT (0.47) KITKDRFLT4EGFRFGFR1
SCHEMBL26101744 0.93 KIT (0.47) KITKDRFLT4EGFRFGFR1
SCHEMBL26099914 0.93 KIT (0.47) KITKDRFLT4EGFRFGFR1
SCHEMBL26099909 0.93 KIT (0.47) KITKDRFLT4EGFRFGFR1
SCHEMBL30891793 0.93 KIT (0.47) KITKDRFLT4EGFRFGFR1
SCHEMBL30394313 0.90 AURKA (0.48) KITKDRFLT4EGFRFGFR1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118201909-A Quinazoline derivative compound and use thereof 株式会社沃若诺伊 2024-06-14 — — CN disclosed
WO-2023075529-A1 QUINAZOLINE DERIVATIVE COMPOUND AND USE THEREOF 보로노이바이오 주식회사 2023-05-04 — — WO disclosed
Send feedback