Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACP3 | P15309 | 2/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.39 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.39 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.39 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1538546 | 0.81 | CYP2A6 (0.54) | ACP3CYP2A6CYP1A2ALDH1A1HSD17B10 | |
| SCHEMBL17502201 | 0.81 | ALDH1A1 (0.46) | ACP3CYP2A6CYP1A2ALDH1A1HSD17B10 | |
| SCHEMBL18242690 | 0.79 | ALDH1A1 (0.39) | ACP3CYP2A6CYP1A2ALDH1A1HSD17B10 | |
| SCHEMBL16933751 | 0.77 | CYP2A6 (0.44) | ACP3CYP2A6CYP1A2ALDH1A1HSD17B10 | |
| SCHEMBL8377365 | 0.77 | ALDH1A1 (0.44) | ACP3CYP2A6CYP1A2ALDH1A1HSD17B10 | |
| SCHEMBL17966497 | 0.77 | CYP2A6 (0.44) | ACP3CYP2A6CYP1A2ALDH1A1HSD17B10 | |
| SCHEMBL11023073 | 0.77 | CYP2A6 (0.44) | ACP3CYP2A6CYP1A2ALDH1A1HSD17B10 | |
| SCHEMBL11844876 | 0.77 | CYP2A6 (0.44) | ACP3CYP2A6CYP1A2ALDH1A1HSD17B10 | |
| SCHEMBL8376250 | 0.77 | KDM4E (0.46) | ACP3CYP2A6CYP1A2ALDH1A1HSD17B10 | |
| SCHEMBL17966537 | 0.77 | CYP1A2 (0.44) | ACP3CYP2A6CYP1A2ALDH1A1HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-6005116-A | HAVE INHIBITION ACTIVITIES AGAINST TYPE A-MONOAMINE OXIDASE; TREATING OR PREVENTING DEPRESSION, PARKINSON'S DISEASE, ALZEHEIMER'S DEMENTIA, OR CEREBROVASCULAR DEMENTIA | SANKYO COMPANY, LIMITED (JP) | 1999-12-21 | — | — | US | disclosed |
| EP-0885891-A1 | ISOXAZOLE DERIVATIVES | SANKYO COMPANY LIMITED (JP) | 1998-12-23 | — | — | EP | disclosed |