Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | ACSS2 | Q9NR19 | 4/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.41 |
| ▸ | PDE4A | P27815 | 1/20 | 0.41 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.41 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.41 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28703458 | 0.99 | HTT (0.47) | HTTLMNAPKMMAPTCYP2C9 | |
| SCHEMBL28702514 | 0.82 | ACSS2 (0.55) | HTTLMNAPKMMAPTCYP2C9 | |
| SCHEMBL29996730 | 0.80 | MAPT (0.53) | HTTLMNAPKMMAPTCYP2C9 | |
| SCHEMBL28689709 | 0.79 | HTT (0.51) | HTTLMNAPKMMAPTCYP2C9 | |
| SCHEMBL22670153 | 0.78 | HPGD (0.41) | MAPTALDH1A1KDM4EEGFRHRH3 | |
| SCHEMBL28933622 | 0.78 | ACSS2 (0.59) | HTTLMNAPKMMAPTCYP2C9 | |
| SCHEMBL28933623 | 0.78 | HTT (0.50) | HTTLMNAPKMMAPTCYP2C9 | |
| SCHEMBL28708842 | 0.77 | LMNA (0.75) | HTTLMNAPKMMAPTCYP2C9 | |
| SCHEMBL28699196 | 0.77 | HTT (0.49) | HTTLMNAPKMMAPTCYP2C9 | |
| SCHEMBL28709872 | 0.76 | HTT (0.57) | HTTLMNAPKMMAPTCYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114008025-A | ACSS2 inhibitors and methods of use thereof | 美特波米德有限公司 | 2022-02-01 | — | — | CN | disclosed |