Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TPSAB1 | Q15661 | 6/20 | 0.55 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.52 |
| ▸ | CTSB | P07858 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.51 |
| ▸ | CCR1 | P32246 | 1/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | CA7 | P43166 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL1386521 | 0.93 | TPSAB1 (0.60) | TPSAB1 | |
| SCHEMBL15772184 | 0.85 | CYP3A4 (0.53) | TPSAB1CYP3A4CYP2D6KCNH2 | |
| SCHEMBL15780781 | 0.84 | TPSAB1 (0.54) | TPSAB1CYP3A4CYP2D6KCNH2 | |
| Trifluoroacetic Acid SCHEMBL4409332 | 0.82 | TPSAB1 (0.55) | TPSAB1 | |
| Trifluoroacetic Acid SCHEMBL4412717 | 0.82 | TPSAB1 (0.55) | TPSAB1 | |
| SCHEMBL18652739 | 0.81 | TPSAB1 (0.52) | TPSAB1CYP3A4CYP2D6KCNH2 | |
| SCHEMBL15788544 | 0.81 | TPSAB1 (0.52) | TPSAB1CYP3A4CYP2D6KCNH2 | |
| SCHEMBL15788466 | 0.80 | TPSAB1 (0.50) | TPSAB1CYP3A4CYP2D6KCNH2 | |
| Trifluoroacetic Acid SCHEMBL4395571 | 0.79 | TPSAB1 (0.59) | TPSAB1 | |
| SCHEMBL1384467 | 0.79 | TPSAB1 (0.53) | TPSAB1CYP3A4CYP2D6KCNH2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1296972-B1 | ARYLMETHYLAMINE DERIVATIVES FOR USE AS TRYPTASE INHIBITORS | AVENTIS PHARMA INC (US) | 2009-12-23 | — | — | EP | claimed |