Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MET | P08581 | 6/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | F2 | P00734 | 2/20 | 0.38 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.38 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.38 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6810142 | 0.86 | PARP1 (0.53) | METPARP1 | |
| SCHEMBL6804348 | 0.80 | PPME1 (0.40) | ALDH1A1PARP1 | |
| SCHEMBL6588502 | 0.76 | MET (0.41) | METGAANPC1F2PRSS1 | |
| SCHEMBL6809771 | 0.67 | TGFBR1 (0.39) | NPC1PARP1 | |
| SCHEMBL3579908 | 0.66 | PARP1 (0.61) | GAANPC1ALDH1A1RAB9APARP1 | |
| SCHEMBL6804341 | 0.66 | PARP1 (0.51) | PARP1 | |
| SCHEMBL3792492 | 0.66 | RAB9A (0.57) | NPC1F2PRSS1ALDH1A1RAB9A | |
| SCHEMBL6804468 | 0.66 | PARP1 (0.40) | PARP1 | |
| SCHEMBL6806385 | 0.66 | CHEK2 (0.40) | GAANPC1ALDH1A1RAB9APARP1 | |
| SCHEMBL17048129 | 0.65 | KDM4E (0.56) | GAANPC1F2ALDH1A1RAB9A |
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-6696437-B1 | Heterocyclically substituted benzimidazoles, the production and application thereof | ABBOTT GMBH & CO. KG (DE) | 2004-02-24 | — | — | US | disclosed |