Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TPSAB1 | Q15661 | 2/20 | 0.35 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.35 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | LOX | P28300 | 2/20 | 0.34 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 SCHEMBL5205473 | 0.94 | TPSAB1 (0.39) | TPSAB1KLKB1ALDH1A1LMNAPOLB | |
| Trifluoroacetic Acid SCHEMBL5208477 | 0.92 | ALDH1A1 (0.37) | TPSAB1CACNA1BALDH1A1LMNAPOLB | |
| Trifluoroacetic Acid SCHEMBL5201746 | 0.92 | CACNA1B (0.36) | TPSAB1CACNA1BALDH1A1LMNAPOLB | |
| Trifluoroacetic Acid SCHEMBL5205240 | 0.92 | MAPK14 (0.39) | TPSAB1CACNA1BKLKB1ALDH1A1LMNA | |
| Trifluoroacetic Acid SCHEMBL5202243 | 0.90 | EPHX2 (0.36) | TPSAB1CACNA1BALDH1A1HTTLOX | |
| Trifluoroacetic Acid SCHEMBL5208348 | 0.90 | RAB9A (0.37) | TPSAB1CACNA1BLOXLOXL2KMT2A | |
| Trifluoroacetic Acid SCHEMBL5203361 | 0.90 | TPSAB1 (0.38) | TPSAB1KLKB1ALDH1A1LMNAPOLB | |
| Trifluoroacetic Acid SCHEMBL5202153 | 0.89 | TSPO (0.41) | ALDH1A1POLBKDM4EKMT2AMEN1 | |
| Trifluoroacetic Acid SCHEMBL5208564 | 0.88 | TPSAB1 (0.37) | TPSAB1KLKB1ALDH1A1LMNAPOLB | |
| Trifluoroacetic Acid SCHEMBL5205467 | 0.88 | SCN9A (0.39) | CACNA1BALDH1A1LOXLOXL2KMT2A |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7160887-B1 | Aromatic amine derivatives, their production and use | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-01-09 | — | — | US | disclosed |
| EP-1123918-B1 | AROMATIC AMINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND AGENTS CONTAINING THE SAME | TAKEDA PHARMACEUTICAL (JP) | 2005-03-09 | — | — | EP | disclosed |
| EP-1123918-A1 | AROMATIC AMINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND AGENTS CONTAINING THE SAME | Takeda Chemical Industries, Ltd. (JP) | 2001-08-16 | — | — | EP | disclosed |