Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7368775

N=C(N)N(Cl)c1cncc2cc(C(=O)NC(CC(=O)O)c3ccccc3)ccc12.O=C(O)C(F)(F)F

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 8/20 0.44
ITGA2B P08514 8/20 0.44
ROCK2 O75116 4/20 0.42
ROCK1 Q13464 1/20 0.42
CTSA P10619 5/20 0.40
SUCNR1 Q9BXA5 2/20 0.39

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
SCHEMBL7369532 0.95 ITGB3 (0.46) ITGB3ITGA2BROCK2ROCK1CTSA
Trifluoroacetic Acid SCHEMBL7377943 0.87 TMPRSS15 (0.44) ITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL7450905 0.86 CA2 (0.44) ROCK2
SCHEMBL6433230 0.85 ROCK2 (0.41) ITGB3ITGA2BROCK2ROCK1
Trifluoroacetic Acid SCHEMBL7368235 0.83 CA2 (0.40) ITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL7372144 0.82 CA1 (0.36) ITGB3ITGA2B
SCHEMBL7370207 0.81 CASP3 (0.46) ITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL7380314 0.81 CA2 (0.40)
Trifluoroacetic Acid SCHEMBL7372438 0.81 GRN (0.45) ITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL7444932 0.78 F2 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1242120-A2 COMBINATIONS OF GROWTH FACTORS AND I:UPA OR I:MMP FOR THE TREATMENT OF DAMAGED TISSUE Pfizer Limited (GB) 2002-09-25 EP disclosed
WO-2001049309-A2 COMBINATIONS OF GROWTH FACTORS AND I: UPA OR I: MMP FOR THE TREATMENT OF DAMAGED TISSUE PFIZER LIMITED (GB) 2001-07-12 WO disclosed
EP-1077945-A1 ISOQUINOLINES AS UROKINASE INHIBITORS PFIZER INC. (US) 2001-02-28 EP disclosed
WO-2000005214-A2 ISOQUINOLINES AS UROKINASE INHIBITORS PFIZER INC. (US) 2000-02-03 WO disclosed