Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
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 SCHEMBL5201682 | 0.90 | ALDH1A1 (0.40) | KMT2AALDH1A1TDP1HPGDMEN1 | |
| Trifluoroacetic Acid SCHEMBL5205398 | 0.90 | TSPO (0.44) | KMT2AALDH1A1KDM4EHPGDMEN1 | |
| Trifluoroacetic Acid SCHEMBL5202690 | 0.88 | ALDH1A1 (0.41) | SMN1; SMN2KMT2AALDH1A1TDP1KDM4E | |
| Trifluoroacetic Acid SCHEMBL5205692 | 0.88 | TSPO (0.39) | KMT2AALDH1A1TDP1KDM4EMEN1 | |
| Trifluoroacetic Acid SCHEMBL5204269 | 0.88 | KMT2A (0.43) | SMN1; SMN2KMT2AALDH1A1TDP1KDM4E | |
| Trifluoroacetic Acid SCHEMBL5205467 | 0.87 | SCN9A (0.39) | KMT2AALDH1A1TDP1HPGDMEN1 | |
| Trifluoroacetic Acid SCHEMBL5201616 | 0.87 | TSPO (0.39) | KMT2AALDH1A1HPGDMEN1CYP1A2 | |
| Trifluoroacetic Acid SCHEMBL5208391 | 0.87 | HCRTR2 (0.39) | KMT2AALDH1A1TDP1KDM4ENPSR1 | |
| Trifluoroacetic Acid SCHEMBL5207856 | 0.85 | KMT2A (0.37) | KMT2AALDH1A1TDP1HPGDMEN1 | |
| Trifluoroacetic Acid SCHEMBL5207332 | 0.84 | TPSAB1 (0.44) | KMT2AALDH1A1MEN1 |
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 |