Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 6/20 | 0.59 |
| ▸ | NFE2L2 | Q16236 | 6/20 | 0.59 |
| ▸ | MAPT | P10636 | 5/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 4/20 | 0.48 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | GFER | P55789 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | GSK3A | P49840 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4720647 | 0.92 | KEAP1 (0.55) | KEAP1NFE2L2MAPTALDH1A1RAB9A | |
| SCHEMBL4722007 | 0.90 | KEAP1 (0.50) | KEAP1NFE2L2MAPTALDH1A1TDP1 | |
| SCHEMBL4724761 | 0.89 | KEAP1 (0.56) | KEAP1NFE2L2MAPTALDH1A1TDP1 | |
| SCHEMBL4722872 | 0.87 | KEAP1 (0.60) | KEAP1NFE2L2MAPTALDH1A1RAB9A | |
| SCHEMBL4720269 | 0.86 | KEAP1 (0.48) | KEAP1NFE2L2MAPTRAB9ANPC1 | |
| SCHEMBL4722720 | 0.83 | KEAP1 (0.49) | KEAP1NFE2L2MAPTALDH1A1TDP1 | |
| SCHEMBL4720939 | 0.78 | MAPT (0.51) | KEAP1NFE2L2MAPTALDH1A1RAB9A | |
| SCHEMBL4721400 | 0.78 | KEAP1 (0.44) | KEAP1NFE2L2MAPTALDH1A1TDP1 | |
| SCHEMBL4721008 | 0.77 | MAPT (0.49) | KEAP1NFE2L2MAPTALDH1A1TDP1 | |
| SCHEMBL4724756 | 0.77 | NPSR1 (0.47) | KEAP1NFE2L2MAPTTDP1GSK3B |
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-1953147-A1 | HETEROCYCLIC COMPOUND AND MEDICINAL APPLICATION THEREOF | Japan Tobacco, Inc. (JP) | 2008-08-06 | — | — | EP | claimed |
| EP-1953147-A1 | HETEROCYCLIC COMPOUND AND MEDICINAL APPLICATION THEREOF | Japan Tobacco, Inc. (JP) | 2008-08-06 | — | — | EP | disclosed |