Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 10/20 | 0.55 |
| ▸ | NPC1 | O15118 | 8/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.55 |
| ▸ | TP53 | P04637 | 4/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.48 |
| ▸ | MEN1 | O00255 | 4/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
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 SCHEMBL8477118 | 0.99 | RAB9A (0.54) | RAB9ANPC1SMN1; SMN2TP53TSHR | |
| SCHEMBL7811108 | 0.91 | ALDH1A1 (0.59) | RAB9ANPC1SMN1; SMN2TP53TSHR | |
| Hydrochloric Acid SCHEMBL8477126 | 0.90 | ALDH1A1 (0.61) | RAB9ANPC1SMN1; SMN2TP53TSHR | |
| SCHEMBL7807122 | 0.87 | RAB9A (0.53) | RAB9ANPC1SMN1; SMN2TP53TSHR | |
| SCHEMBL7810244 | 0.79 | RAB9A (0.60) | RAB9ANPC1SMN1; SMN2TP53TSHR | |
| SCHEMBL7813794 | 0.78 | RAB9A (0.59) | RAB9ANPC1SMN1; SMN2TP53TSHR | |
| SCHEMBL7801871 | 0.77 | RAB9A (0.58) | RAB9ANPC1SMN1; SMN2TP53TSHR | |
| Hydrochloric Acid SCHEMBL8475101 | 0.77 | RAB9A (0.58) | RAB9ANPC1SMN1; SMN2TP53TSHR | |
| Hydrochloric Acid SCHEMBL8480228 | 0.76 | RAB9A (0.56) | RAB9ANPC1SMN1; SMN2TP53TSHR | |
| SCHEMBL7801801 | 0.75 | RAB9A (0.55) | RAB9ANPC1SMN1; SMN2TP53TSHR |
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 |