Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6161392

N[C@@H](Cc1csc2ccccc12)C(=O)O.O=C(O)C(F)(F)F

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.48
DPP8 Q6V1X1 2/20 0.48
DPP9 Q86TI2 2/20 0.48
CYP2A6 P11509 2/20 0.46
ALPI P09923 1/20 0.46
PKM P14618 1/20 0.46
PTGS1 P23219 1/20 0.46
XIAP P98170 1/20 0.46
SLC7A5 Q01650 1/20 0.46
MAPT P10636 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.46
LMNA P02545 1/20 0.46
MPO P05164 1/20 0.46
TSHR P16473 1/20 0.46
BLM P54132 1/20 0.46
PMP22 Q01453 1/20 0.46
KMT2A Q03164 1/20 0.46
HIF1A Q16665 1/20 0.46
OPRD1 P41143 1/20 0.45

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
SCHEMBL2466886 0.92 CYP2A6 (0.54) DPP4DPP8DPP9CYP2A6ALPI
SCHEMBL514508 0.92 CYP2A6 (0.54) DPP4DPP8DPP9CYP2A6ALPI
SCHEMBL1421072 0.92 CYP2A6 (0.54) DPP4DPP8DPP9CYP2A6ALPI
SCHEMBL29373380 0.92 CYP2A6 (0.54) DPP4DPP8DPP9CYP2A6ALPI
SCHEMBL514509 0.92 CYP2A6 (0.54) DPP4DPP8DPP9CYP2A6ALPI
Hydrochloric Acid SCHEMBL4903646 0.90 CYP2A6 (0.53) DPP4DPP8DPP9CYP2A6ALPI
Hydrochloric Acid SCHEMBL31036845 0.90 CYP2A6 (0.53) DPP4DPP8DPP9CYP2A6ALPI
Hydrochloric Acid SCHEMBL4903643 0.90 CYP2A6 (0.53) DPP4DPP8DPP9CYP2A6ALPI
SCHEMBL6161396 0.81 DPP4 (0.46) DPP4DPP8DPP9CYP2A6OPRD1
SCHEMBL28905932 0.80 CYP2A6 (0.54) DPP4DPP8DPP9CYP2A6OPRD1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0828754-B1 DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE PFIZER (US) 2005-02-02 EP disclosed
US-5936089-A PIPERIDINE DERIVATIVES; BONE DISORDERS; OBESITY; AGING; CACHEXIA ASSOCIATED WITH AIDS AND CANCER PFIZER INC (US) 1999-08-10 US disclosed
WO-1996035713-A1 DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE PFIZER, INC. (US) 1996-11-14 WO disclosed