Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | TSPO | P30536 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | PLAU | P00749 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
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 SCHEMBL5205398 | 0.95 | TSPO (0.44) | ALDH1A1KDM4ETSPOPOLBKMT2A | |
| Trifluoroacetic Acid SCHEMBL5205692 | 0.94 | TSPO (0.39) | ALDH1A1KDM4ETSPOLMNAPOLB | |
| Trifluoroacetic Acid SCHEMBL5204269 | 0.93 | KMT2A (0.43) | ALDH1A1KDM4ETSPOLMNAPOLB | |
| Trifluoroacetic Acid SCHEMBL5204427 | 0.93 | ALDH1A1 (0.41) | ALDH1A1KDM4ETSPOLMNAPOLB | |
| Trifluoroacetic Acid SCHEMBL5201616 | 0.92 | TSPO (0.39) | ALDH1A1TSPOLMNAKMT2APKM | |
| Trifluoroacetic Acid SCHEMBL5208391 | 0.92 | HCRTR2 (0.39) | ALDH1A1KDM4ETSPOLMNAPOLB | |
| Trifluoroacetic Acid SCHEMBL5204867 | 0.90 | ALDH1A1 (0.42) | ALDH1A1KDM4ETSPOLMNAPOLB | |
| Trifluoroacetic Acid SCHEMBL5205760 | 0.90 | ALDH1A1 (0.39) | ALDH1A1KDM4ETSPOLMNAPOLB | |
| Trifluoroacetic Acid SCHEMBL5208934 | 0.89 | ALDH1A1 (0.43) | ALDH1A1KDM4ETSPOLMNAPOLB | |
| Trifluoroacetic Acid SCHEMBL5203166 | 0.89 | ALDH1A1 (0.39) | ALDH1A1KDM4ETSPOLMNAPOLB |
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 |