Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | XDH | P47989 | 1/20 | 0.44 |
| ▸ | FLT3 | P36888 | 1/20 | 0.42 |
| ▸ | GRIN1 | Q05586 | 3/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | ACSS2 | Q9NR19 | 1/20 | 0.39 |
| ▸ | CHEK2 | O96017 | 4/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | DHODH | Q02127 | 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 | |
|---|---|---|---|---|
| SCHEMBL8473988 | 0.89 | GRIN1 (0.50) | GRIN1GRIN2BCHEK2CYP1A2CYP2E1 | |
| SCHEMBL12961102 | 0.77 | SCN10A (0.46) | L3MBTL1CYP1A2CYP2E1CYP3A4CYP2C8 | |
| SCHEMBL15294544 | 0.75 | NPSR1 (0.61) | KMT2AL3MBTL1CYP1A2CYP2C9 | |
| SCHEMBL30167015 | 0.75 | KMT2A (0.47) | KMT2AXDHFLT3GRIN1GRIN2B | |
| SCHEMBL5475981 | 0.75 | KMT2A (0.53) | KMT2AXDHFLT3GRIN1GRIN2B | |
| SCHEMBL7806900 | 0.74 | GRIN1 (0.56) | KMT2AXDHFLT3GRIN1GRIN2B | |
| SCHEMBL7813702 | 0.72 | GRIN1 (0.53) | KMT2AXDHGRIN1GRIN2BTDP1 | |
| SCHEMBL7807068 | 0.71 | GRIN1 (0.56) | KMT2AGRIN1GRIN2BTDP1 | |
| SCHEMBL7808653 | 0.71 | GRIN1 (0.56) | KMT2AGRIN1GRIN2BCHEK2 | |
| SCHEMBL7808790 | 0.71 | GRIN1 (0.56) | KMT2AFLT3GRIN1GRIN2BTDP1 |
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 3 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 |
| US-5972968-A | INTERLEUKIN INHIBITOR | ADIR ET COMPAGNIE (FR) | 1999-10-26 | — | — | US | disclosed |
| EP-0820990-A2 | Novel benzimidazole, benzoxazole, and benzothiazole derivatives useful as interleukin 1beta inhibitors | ADIR ET COMPAGNIE (FR) | 1998-01-28 | — | — | EP | disclosed |