Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 10/20 | 0.54 |
| ▸ | PKM | P14618 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 8/20 | 0.50 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.50 |
| ▸ | PIM1 | P11309 | 1/20 | 0.50 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.50 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.50 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.50 |
| ▸ | FLT3 | P36888 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.50 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.45 |
| ▸ | CDK1 | P06493 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL10855889 | 0.99 | RAB9A (0.52) | RAB9APKMNPC1ADORA3PIM1 | |
| SCHEMBL10859545 | 0.99 | RAB9A (0.52) | RAB9APKMNPC1ADORA3PIM1 | |
| SCHEMBL10851321 | 0.88 | RAB9A (0.50) | RAB9APKMNPC1ADORA3PIM1 | |
| SCHEMBL10855804 | 0.88 | RAB9A (0.50) | RAB9APKMNPC1ADORA3PIM1 | |
| SCHEMBL3258353 | 0.79 | TRPV1 (0.60) | RAB9APKMNPC1SMN1; SMN2GAA | |
| SCHEMBL17186261 | 0.78 | KMT2A (0.50) | RAB9ANPC1SMN1; SMN2LMNAGAA | |
| SCHEMBL16585513 | 0.78 | TRPV1 (0.59) | RAB9APKMNPC1SMN1; SMN2GAA | |
| Hydrochloric Acid SCHEMBL18605995 | 0.77 | TP53 (0.49) | RAB9ANPC1SMN1; SMN2LMNAGAA | |
| SCHEMBL10857693 | 0.75 | MDM2 (0.53) | RAB9ALMNAMEN1KMT2AEPHX2 | |
| SCHEMBL9750118 | 0.75 | NPC1 (0.81) | RAB9APKMNPC1ADORA3PIM1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4565826-A | HYPOTENSIVE, CARDIONASCULAR, ANTIULCER, ANTISECRETORY, GASTROINTESTINAL DISORDERS | WILLIAM H. RORER, INC. (US) | 1986-01-21 | — | — | US | disclosed |
| US-4436911-A | HYPOTENSIVE, ANTISPASMODIC, ANTIULCER, ANTIPARASITIC | WILLIAM H. RORER, INC. (US) | 1984-03-13 | — | — | US | disclosed |