Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | PRKDC | P78527 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL16742522 | 0.83 | KMT2A (0.53) | ALDH1A1KDM4EGAAKMT2ANPSR1 | |
| SCHEMBL2068134 | 0.80 | PIM1 (0.33) | — | |
| SCHEMBL2744826 | 0.77 | BTK (0.41) | ALDH1A1KDM4EGAAKMT2ANPSR1 | |
| SCHEMBL3123096 | 0.77 | BTK (0.41) | ALDH1A1KDM4EGAAKMT2ANPSR1 | |
| SCHEMBL2067363 | 0.74 | HTR3E (0.37) | ALDH1A1KDM4EGAAKMT2ATDP1 | |
| SCHEMBL2068403 | 0.74 | KDM4E (0.40) | ALDH1A1KDM4EGAAKMT2ATDP1 | |
| SCHEMBL1819991 | 0.73 | KMT2A (0.46) | ALDH1A1KDM4EGAAKMT2ANPSR1 | |
| SCHEMBL14818751 | 0.73 | HTR3E (0.53) | ALDH1A1KDM4EGAAKMT2ANPSR1 | |
| SCHEMBL18436315 | 0.73 | KMT2A (0.53) | ALDH1A1KDM4EGAAKMT2ANPSR1 | |
| SCHEMBL18436950 | 0.73 | KMT2A (0.53) | ALDH1A1KDM4EGAAKMT2ANPSR1 |
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-118076581-A | Iron death modulators, their preparation and use | 维泰瑞隆有限公司 | 2024-05-24 | — | — | CN | disclosed |