Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.39 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 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 | |
|---|---|---|---|---|
| SCHEMBL8101681 | 0.84 | KDM4E (0.61) | KDM4EALDH1A1NPC1RAB9APKM | |
| SCHEMBL8105784 | 0.83 | KDM4E (0.52) | KDM4EALDH1A1NPC1RAB9APKM | |
| SCHEMBL7925160 | 0.81 | KDM4E (0.59) | KDM4EALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL8100199 | 0.76 | KDM4E (0.64) | KDM4EALDH1A1NPC1RAB9APKM | |
| SCHEMBL1658662 | 0.76 | RAD51 (0.49) | KDM4EALDH1A1NPC1RAB9APKM | |
| SCHEMBL16375038 | 0.76 | KDM4E (0.49) | KDM4EALDH1A1NPC1RAB9APKM | |
| SCHEMBL1661610 | 0.75 | KDM4E (0.62) | KDM4EALDH1A1NPC1RAB9APKM | |
| SCHEMBL8101672 | 0.74 | KDM4E (0.65) | KDM4EALDH1A1NPC1RAB9APKM | |
| SCHEMBL8108176 | 0.74 | KDM4E (0.56) | KDM4EALDH1A1NPC1RAB9APKM | |
| SCHEMBL21902775 | 0.74 | MEN1 (0.55) | ALDH1A1GAAMAPTMEN1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2014179401-A1 | 2-ARYLNAPHTHYRIDIN-4-ONES AS POTENT ANTITUMOR AGENTS TARGETING TUMORIGENIC CELL LINES | KUO SHENG-CHU | 2014-11-06 | — | — | WO | disclosed |