Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.43 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.41 |
| ▸ | RHEB | Q15382 | 1/20 | 0.39 |
| ▸ | LTA4H | P09960 | 2/20 | 0.39 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.39 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.39 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8524865 | 0.99 | TDP1 (0.48) | TDP1LMNACHEK2CYP19A1GRIN1 | |
| SCHEMBL7806832 | 0.90 | CHEK2 (0.51) | TDP1LMNACHEK2CYP19A1GRIN1 | |
| Hydrochloric Acid SCHEMBL8524871 | 0.89 | CHEK2 (0.50) | TDP1LMNACHEK2CYP19A1GRIN1 | |
| SCHEMBL7806900 | 0.85 | GRIN1 (0.56) | TDP1LMNAGRIN1GRIN2BRHEB | |
| SCHEMBL7807032 | 0.84 | TDP1 (0.43) | TDP1LMNAGRIN1GRIN2BRHEB | |
| Hydrochloric Acid SCHEMBL8480108 | 0.83 | TDP1 (0.42) | TDP1LMNAGRIN1GRIN2BRHEB | |
| SCHEMBL28967661 | 0.80 | LMNA (0.53) | TDP1LMNACHEK2CYP19A1LTA4H | |
| SCHEMBL30166989 | 0.80 | LMNA (0.53) | TDP1LMNACHEK2CYP19A1LTA4H | |
| SCHEMBL7811234 | 0.80 | GRIN1 (0.49) | TDP1CHEK2GRIN1GRIN2BRHEB | |
| Hydrochloric Acid SCHEMBL8478920 | 0.77 | GRIN1 (0.47) | TDP1LMNACHEK2GRIN1GRIN2B |
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 |
|---|---|---|---|---|---|---|---|
| EP-0820990-B1 | Benzimidazole, benzoxazole, and benzothiazole derivatives useful as interleukin 1beta inhibitors | ADIR (FR) | 2001-01-17 | — | — | EP | disclosed |
| EP-0820990-A2 | Novel benzimidazole, benzoxazole, and benzothiazole derivatives useful as interleukin 1beta inhibitors | ADIR ET COMPAGNIE (FR) | 1998-01-28 | — | — | EP | disclosed |