Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | RAF1 | P04049 | 1/20 | 0.43 |
| ▸ | BRAF | P15056 | 1/20 | 0.43 |
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | TNKS | O95271 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | PLAU | P00749 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6556065 | 0.89 | NPC1 (0.53) | RAB9ANPC1MAPTCASP3ADORA3 | |
| SCHEMBL7276640 | 0.89 | MGLL (0.46) | RAB9ANPC1MAPTRAF1BRAF | |
| SCHEMBL7276441 | 0.88 | ALDH1A1 (0.51) | RAB9ANPC1CASP3ADORA3ADORA2A | |
| SCHEMBL4416727 | 0.78 | NPC1 (0.62) | RAB9ANPC1CASP3ALDH1A1ROCK2 | |
| SCHEMBL1330921 | 0.76 | CASP3 (0.51) | RAB9ANPC1MAPTCASP3KMT2A | |
| SCHEMBL12348789 | 0.76 | RAB9A (0.65) | RAB9ANPC1MAPTGAAKMT2A | |
| SCHEMBL7342183 | 0.76 | NPC1 (0.56) | RAB9ANPC1MAPTCASP3KMT2A | |
| SCHEMBL21577153 | 0.75 | LNPEP (0.61) | RAB9ANPC1MAPTGAAALDH1A1 | |
| SCHEMBL5113764 | 0.75 | NPC1 (0.54) | RAB9ANPC1MAPTCASP3ALDH1A1 | |
| SCHEMBL872167 | 0.75 | RAB9A (0.54) | RAB9ANPC1MAPTGAAKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0509769-B1 | Heterocyclic amides having HLE inhibiting activity | ZENECA LTD (GB) | 1996-09-11 | — | — | EP | disclosed |
| US-5521179-A | Heterocyclic amides | ZENECA LIMITED (GB) | 1996-05-28 | — | — | US | disclosed |
| EP-0509769-A2 | Heterocyclic amides having HLE inhibiting activity | ZENECA LIMITED (GB) | 1992-10-21 | — | — | EP | disclosed |