Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.44 |
| ▸ | DAO | P14920 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 5/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | TK1 | P04183 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL30728403 | 0.81 | CYP19A1 (0.57) | ALDH1A1P2RX4CYP2C19CYP19A1KDM4E | |
| SCHEMBL6719104 | 0.78 | NPC1 (0.53) | ALDH1A1DAOPARP1CYP2C9KDM4E | |
| SCHEMBL2980047 | 0.78 | ALDH1A1 (0.54) | ALDH1A1DAOPARP1CYP2C9CYP2C19 | |
| SCHEMBL6731313 | 0.78 | ALDH1A1 (0.50) | ALDH1A1P2RX4DAOPARP1KDM4E | |
| SCHEMBL6719602 | 0.77 | ALDH1A1 (0.75) | ALDH1A1DAOCYP2C9CYP2C19TK1 | |
| SCHEMBL6027805 | 0.74 | CYP1A2 (0.64) | ALDH1A1DAOPARP1KDM4ECYP1A2 | |
| SCHEMBL8377270 | 0.74 | KDM4E (0.64) | ALDH1A1PARP1KDM4E | |
| SCHEMBL27691590 | 0.73 | ALDH1A1 (0.70) | ALDH1A1DAOCYP2C9CYP2C19TK1 | |
| SCHEMBL27691593 | 0.73 | ALDH1A1 (0.55) | ALDH1A1DAOCYP2C9CYP2C19TK1 | |
| SCHEMBL9394061 | 0.73 | ALDH1A1 (0.51) | ALDH1A1CYP2C9CYP2C19TK1L3MBTL1 |
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-6673804-B1 | PREVENTING OR TREATING ARTHRITIS (PARTICULARLY OSTEOARTHRITIS) OR INHIBITING METASTASIS, INVASION OR GROWTH OF CANCER (PARTICULARLY BREAST CANCER) | SANKYO COMPANY, LIMITED (JP) | 2004-01-06 | — | — | US | disclosed |
| EP-1069110-A1 | SULFONAMIDE DERIVATIVES | Sankyo Company Limited (JP) | 2001-01-17 | — | — | EP | disclosed |