Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.61 |
| ▸ | POLB | P06746 | 2/20 | 0.61 |
| ▸ | LMNA | P02545 | 2/20 | 0.61 |
| ▸ | MAPT | P10636 | 1/20 | 0.61 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.60 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.53 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.53 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.53 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.53 |
| ▸ | FAAH | O00519 | 1/20 | 0.52 |
| ▸ | MGLL | Q99685 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL2930608 | 0.89 | ALDH1A1 (0.71) | ALDH1A1KDM4EMAPK1SMN1; SMN2POLB | |
| SCHEMBL27162215 | 0.84 | ALDH1A1 (0.53) | ALDH1A1KDM4EMAPK1SMN1; SMN2POLB | |
| SCHEMBL16431003 | 0.80 | CYP2D6 (0.78) | ALDH1A1MAPK1MEN1KMT2ACYP2D6 | |
| SCHEMBL15800712 | 0.80 | ALDH1A1 (0.78) | ALDH1A1KDM4EMAPK1SMN1; SMN2POLB | |
| SCHEMBL922597 | 0.78 | ALDH1A1 (0.70) | ALDH1A1KDM4EMAPK1SMN1; SMN2POLB | |
| SCHEMBL2659175 | 0.78 | ALDH1A1 (0.72) | ALDH1A1KDM4EMAPK1SMN1; SMN2POLB | |
| SCHEMBL5197063 | 0.77 | CCR8 (0.74) | ALDH1A1KDM4EMAPK1SMN1; SMN2LMNA | |
| SCHEMBL5207400 | 0.77 | ALDH1A1 (0.45) | ALDH1A1KDM4EMAPK1SMN1; SMN2POLB | |
| SCHEMBL4717096 | 0.77 | SIGMAR1 (0.71) | ALDH1A1KDM4EMAPK1SMN1; SMN2POLB | |
| SCHEMBL922442 | 0.76 | ALDH1A1 (0.68) | ALDH1A1KDM4EMAPK1SMN1; SMN2POLB |
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-2022228547-A1 | PHOSPHONYL DERIVATIVE, AND COMPOSITION AND PHARMACEUTICAL APPLICATION THEREOF | 四川海思科制药有限公司 | 2022-11-03 | — | — | WO | disclosed |