Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 2/20 | 0.38 |
| ▸ | PPARA | Q07869 | 2/20 | 0.38 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.38 |
| ▸ | BAD | Q92934 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8754771 | 0.89 | CYP2C9 (0.50) | MEN1KMT2AATMHTTCYP2C9 | |
| SCHEMBL11003311 | 0.81 | CYP2C9 (0.44) | MEN1KMT2AHTTCYP2C9CYP2C19 | |
| SCHEMBL74368 | 0.80 | LMNA (0.44) | SMN1; SMN2CYP2C9CYP2C19HSD17B10GAA | |
| SCHEMBL4552643 | 0.80 | LMNA (0.44) | SMN1; SMN2CYP2C9CYP2C19HSD17B10GAA | |
| SCHEMBL5110593 | 0.79 | GAA (0.53) | MEN1KMT2AATMHTTNPC1 | |
| SCHEMBL10784200 | 0.79 | HSD17B10 (0.68) | MEN1KMT2AHTTNPC1RAB9A | |
| SCHEMBL10783459 | 0.79 | ALDH1A1 (0.53) | MEN1KMT2AATMHTTSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL8340018 | 0.78 | LMNA (0.43) | MEN1KMT2ASMN1; SMN2CYP2C9CYP2C19 | |
| SCHEMBL11097086 | 0.76 | LDHA (0.50) | MEN1KMT2AATMNPC1RAB9A | |
| SCHEMBL27618192 | 0.76 | MEN1 (0.44) | MEN1KMT2AATMHTTNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115974890-A | Lycorine derivative, preparation method thereof and application thereof in preparing antitumor drugs | 山东达因海洋生物制药股份有限公司 | 2023-04-18 | — | — | CN | disclosed |
| CN-109897022-B | Sphaelactone derivative, pharmaceutical composition thereof, preparation method and application thereof | 中国医学科学院药物研究所 | 2021-09-14 | — | — | CN | disclosed |