Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | PLAU | P00749 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TSPO | P30536 | 1/20 | 0.37 |
| ▸ | TPSAB1 | Q15661 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SSTR5 | P35346 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | PLG | P00747 | 1/20 | 0.35 |
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 SCHEMBL5205760 | 0.97 | ALDH1A1 (0.39) | ALDH1A1HTTNPSR1LMNAPOLB | |
| Trifluoroacetic Acid SCHEMBL5205829 | 0.95 | SSTR5 (0.39) | ALDH1A1HTTNPSR1LMNAPOLB | |
| Trifluoroacetic Acid SCHEMBL5203166 | 0.94 | ALDH1A1 (0.39) | ALDH1A1HTTNPSR1LMNAPOLB | |
| Trifluoroacetic Acid SCHEMBL5205888 | 0.94 | ALDH1A1 (0.37) | ALDH1A1HTTNPSR1LMNAPOLB | |
| Trifluoroacetic Acid SCHEMBL5208477 | 0.93 | ALDH1A1 (0.37) | ALDH1A1HTTNPSR1LMNAPOLB | |
| Trifluoroacetic Acid SCHEMBL5204867 | 0.93 | ALDH1A1 (0.42) | ALDH1A1HTTNPSR1LMNAPOLB | |
| Trifluoroacetic Acid SCHEMBL5202539 | 0.93 | ALDH1A1 (0.38) | ALDH1A1HTTNPSR1LMNAPOLB | |
| Trifluoroacetic Acid SCHEMBL5202498 | 0.93 | EPHX2 (0.38) | ALDH1A1HTTKDM4ETSPOTPSAB1 | |
| Trifluoroacetic Acid SCHEMBL5202690 | 0.93 | ALDH1A1 (0.41) | ALDH1A1HTTNPSR1LMNAPOLB | |
| Trifluoroacetic Acid SCHEMBL5207332 | 0.93 | TPSAB1 (0.44) | ALDH1A1MEN1KMT2ATSPOTPSAB1 |
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 |