Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | GCK | P35557 | 1/20 | 0.38 |
| ▸ | CBFB | Q13951 | 1/20 | 0.37 |
| ▸ | RAD52 | P43351 | 1/20 | 0.36 |
| ▸ | RHEB | Q15382 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | TPSAB1 | Q15661 | 3/20 | 0.35 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.35 |
| ▸ | F2 | P00734 | 1/20 | 0.35 |
| ▸ | F10 | P00742 | 1/20 | 0.35 |
| ▸ | PLG | P00747 | 1/20 | 0.35 |
| ▸ | PLAU | P00749 | 1/20 | 0.35 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.35 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 3/20 | 0.35 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.35 |
| ▸ | PRKD3 | O94806 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8479187 | 0.99 | TDP1 (0.49) | TDP1NPSR1GCKCBFBRAD52 | |
| SCHEMBL7808661 | 0.91 | TDP1 (0.43) | TDP1NPSR1GCKRHEBKMT2A | |
| Hydrochloric Acid SCHEMBL8479183 | 0.90 | TDP1 (0.42) | TDP1NPSR1GCKRAD52RHEB | |
| SCHEMBL7808593 | 0.80 | TDP1 (0.54) | TDP1NPSR1RAD52KMT2APOLB | |
| Hydrochloric Acid SCHEMBL8480485 | 0.78 | TDP1 (0.52) | TDP1NPSR1RAD52KMT2APOLB | |
| SCHEMBL7808619 | 0.78 | TDP1 (0.52) | TDP1NPSR1CBFBRHEBKMT2A | |
| Hydrochloric Acid SCHEMBL8479272 | 0.77 | TDP1 (0.51) | TDP1NPSR1CBFBRAD52KMT2A | |
| Hydrochloric Acid SCHEMBL8477383 | 0.74 | TDP1 (0.48) | TDP1NPSR1RAD52KMT2APOLB | |
| SCHEMBL12635706 | 0.72 | TDP1 (0.55) | TDP1NPSR1RAD52KMT2APOLB | |
| SCHEMBL7809674 | 0.69 | TDP1 (0.40) | TDP1NPSR1CBFBDYRK1BALDH1A1 |
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 |