Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.42 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 1/20 | 0.41 |
| ▸ | CRHBP | P24387 | 1/20 | 0.40 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.40 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.40 |
| ▸ | KDM5A | P29375 | 1/20 | 0.39 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.39 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.39 |
| ▸ | PTPRC | P08575 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5034698 | 0.74 | MAOB (0.57) | NPC1RAB9AKDM4EALDH1A1CYP2A6 | |
| SCHEMBL9536812 | 0.72 | ALDH1A1 (0.60) | KDM4EALDH1A1GLAGAAL3MBTL1 | |
| SCHEMBL3836372 | 0.72 | KDM4E (0.50) | KDM4EALDH1A1GLAGAAL3MBTL1 | |
| SCHEMBL1462351 | 0.71 | MAOB (0.46) | NPC1RAB9AKDM4EALDH1A1CYP2A6 | |
| SCHEMBL9536884 | 0.71 | KDM4E (0.46) | NPC1RAB9AKDM4EALDH1A1GLA | |
| SCHEMBL8123121 | 0.71 | CYP2A6 (0.49) | NPC1RAB9AKDM4EALDH1A1CYP2A6 | |
| SCHEMBL4474609 | 0.71 | MDM2 (0.62) | KDM4EALDH1A1GLAGAAL3MBTL1 | |
| SCHEMBL622794 | 0.71 | KDM4E (0.64) | NPC1RAB9AKDM4EALDH1A1GLA | |
| SCHEMBL11937479 | 0.70 | MAOB (0.47) | NPC1RAB9AKDM4EALDH1A1CYP2A6 | |
| SCHEMBL9754547 | 0.70 | MCL1 (0.55) | KDM4EALDH1A1GLAGAAL3MBTL1 |
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-0532531-A1 | PHENOL AND PYRIDINOL DERIVATIVES AS PHARMACEUTICALS | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1993-03-24 | — | — | EP | disclosed |
| WO-1991017987-A1 | PHENOL AND PYRIDINOL DERIVATIVES AS PHARMACEUTICALS | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1991-11-28 | — | — | WO | disclosed |