Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 4/20 | 0.50 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.48 |
| ▸ | GFER | P55789 | 1/20 | 0.48 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.48 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.45 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.44 |
| ▸ | DHODH | Q02127 | 1/20 | 0.44 |
| ▸ | NEU3 | Q9UQ49 | 1/20 | 0.43 |
| ▸ | PLAU | P00749 | 1/20 | 0.43 |
| ▸ | F10 | P00742 | 1/20 | 0.43 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.42 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.42 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13478362 | 0.81 | HDAC1 (0.56) | HDAC1HDAC3HDAC2KDM4EAPOBEC3A | |
| SCHEMBL17205965 | 0.80 | DHODH (0.52) | HDAC1HDAC3HDAC2KDM4EAPOBEC3A | |
| SCHEMBL28197533 | 0.80 | KDM4E (0.55) | HDAC1HDAC3HDAC2KDM4EAPOBEC3A | |
| SCHEMBL6259587 | 0.79 | F10 (0.52) | HDAC1NEU3F10MEN1KMT2A | |
| SCHEMBL5213164 | 0.78 | KDM4E (0.59) | HDAC1HDAC3HDAC2KDM4EAPOBEC3A | |
| SCHEMBL2026663 | 0.77 | L3MBTL1 (0.52) | CHEK2DHODHPLAUMKNK1MEN1 | |
| SCHEMBL30903715 | 0.77 | L3MBTL1 (0.52) | CHEK2DHODHPLAUMKNK1MEN1 | |
| SCHEMBL99181 | 0.77 | ALDH1A1 (0.59) | HDAC1KDM4EAPOBEC3AGFERAPOBEC3G | |
| SCHEMBL17206259 | 0.76 | KDM4E (0.52) | HDAC1KDM4EAPOBEC3AGFERAPOBEC3G | |
| SCHEMBL2026285 | 0.76 | ESR2 (0.55) | CHEK2DHODHMKNK1MKNK2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020183011-A1 | HTR1D INHIBITORS AND USES THEREOF IN THE TREATMENT OF CANCER | INSTITUT CURIE (FR) | 2020-09-17 | — | — | WO | disclosed |
| EP-0752982-A1 | BIPHENYL DERIVATIVES AS 5HT1D ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1997-01-15 | — | — | EP | disclosed |
| WO-1995026328-A1 | BIPHENYL DERIVATIVES AS 5HT1D ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1995-10-05 | — | — | WO | disclosed |