Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HINT1 | P49773 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | NT5E | P21589 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.35 |
| ▸ | SLC29A1 | Q99808 | 3/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.35 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | RNASEL | Q05823 | 2/20 | 0.34 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.33 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.33 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.33 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.33 |
| ▸ | P2RX2 | Q9UBL9 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8529887 | 0.97 | HINT1 (0.40) | HINT1ALDH1A1LMNATP53MAPT | |
| SCHEMBL8988189 | 0.95 | HINT1 (0.38) | HINT1ALDH1A1LMNATP53MAPT | |
| SCHEMBL8533343 | 0.91 | HINT1 (0.40) | HINT1ALDH1A1LMNATP53MAPT | |
| SCHEMBL8529436 | 0.89 | ALDH1A1 (0.48) | HINT1ALDH1A1LMNATP53MAPT | |
| SCHEMBL8530537 | 0.88 | P2RX3 (0.46) | HINT1ALDH1A1LMNATP53MAPT | |
| SCHEMBL8529155 | 0.88 | ALDH1A1 (0.52) | HINT1ALDH1A1LMNATP53MAPT | |
| SCHEMBL8528882 | 0.87 | HINT1 (0.45) | HINT1NT5ECYP2C19ADORA3SLC29A1 | |
| SCHEMBL8529223 | 0.87 | HINT1 (0.45) | HINT1NT5ECYP2C19HSP90B1ADORA3 | |
| SCHEMBL8530371 | 0.85 | HINT1 (0.40) | HINT1ALDH1A1LMNATP53MAPT | |
| SCHEMBL8530375 | 0.85 | P2RX3 (0.46) | HINT1ALDH1A1LMNATP53MAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5821236-A | Tumor treatment with arabinofuranosyl purine derivatives | GLAXO WELLCOME INC. (US) | 1998-10-13 | — | — | US | disclosed |
| US-5747472-A | ANTICARCINOGENIC AGENTS AND ANTITUMOR AGENTS | GLAXO WELLCOME INC. (US) | 1998-05-05 | — | — | US | disclosed |
| US-5424295-A | Useful in treatment of varicella-zoster virus infections | BURROUGHS WELLCOME CO. (US) | 1995-06-13 | — | — | US | disclosed |
| WO-1992001456-A1 | HETEROCYCLIC COMPOUNDS | THE WELLCOME FOUNDATION LIMITED (GB) | 1992-02-06 | — | — | WO | disclosed |