Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | HTT | P42858 | 2/20 | 0.53 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 6/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.52 |
| ▸ | NPC1 | O15118 | 3/20 | 0.52 |
| ▸ | PPIA | P62937 | 6/20 | 0.52 |
| ▸ | SGMS2 | Q8NHU3 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9126340 | 0.91 | PPIA (0.54) | ALDH1A1LMNAKMT2AHTTALOX12 | |
| SCHEMBL9123645 | 0.86 | PPIA (0.52) | HTTRAB9ANPC1PPIASGMS2 | |
| SCHEMBL9125099 | 0.84 | PPIA (0.72) | KMT2APPIACYP1A2CYP2C19MEN1 | |
| SCHEMBL9123692 | 0.82 | PPIA (0.49) | ALDH1A1LMNAKMT2AHTTALOX12 | |
| SCHEMBL16566478 | 0.80 | RAB9A (0.81) | ALDH1A1LMNAKMT2AHTTALOX12 | |
| SCHEMBL9125557 | 0.80 | PPIA (0.60) | ALDH1A1LMNAKMT2AHTTALOX12 | |
| SCHEMBL9126341 | 0.79 | PPIA (0.56) | ALDH1A1LMNAKMT2ARAB9APPIA | |
| SCHEMBL9124394 | 0.79 | PPIA (0.68) | KMT2AALOX12PPIACYP1A2CYP2C19 | |
| SCHEMBL9126866 | 0.79 | PPIA (0.52) | ALDH1A1LMNAKMT2AHTTALOX12 | |
| SCHEMBL9126123 | 0.77 | PPIA (0.54) | KMT2AHTTL3MBTL1RAB9ANPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5409943-A | [(alkoxy)pyridinyl]amine compounds which are useful in the treatment of gastrointestinal disorders | SMITHKLINE BEECHAM INTERCREDIT B.V. (NL) | 1995-04-25 | — | — | US | disclosed |