Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.45 |
| ▸ | DRD4 | P21917 | 1/20 | 0.45 |
| ▸ | DRD3 | P35462 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL25423311 | 0.87 | ALDH1A1 (0.50) | SMN1; SMN2ALDH1A1HPGDRAB9ADRD2 | |
| SCHEMBL16309064 | 0.86 | SMN1; SMN2 (0.51) | SMN1; SMN2ALDH1A1HPGDRAB9ADRD2 | |
| SCHEMBL1702035 | 0.86 | KDM4E (0.44) | SMN1; SMN2ALDH1A1HPGDRAB9ATSHR | |
| SCHEMBL25780650 | 0.86 | SMN1; SMN2 (0.46) | SMN1; SMN2ALDH1A1HPGDRAB9ADRD2 | |
| SCHEMBL16309075 | 0.85 | SMN1; SMN2 (0.50) | SMN1; SMN2ALDH1A1HPGDRAB9ADRD2 | |
| SCHEMBL16309072 | 0.84 | SMN1; SMN2 (0.49) | SMN1; SMN2ALDH1A1HPGDRAB9ADRD2 | |
| SCHEMBL15017169 | 0.82 | SMN1; SMN2 (0.47) | SMN1; SMN2ALDH1A1HPGDRAB9ADRD2 | |
| SCHEMBL24713047 | 0.82 | DRD2 (0.48) | SMN1; SMN2ALDH1A1HPGDRAB9ADRD2 | |
| SCHEMBL1701947 | 0.81 | L3MBTL1 (0.40) | SMN1; SMN2ALDH1A1RAB9ANPC1LMNA | |
| SCHEMBL25786093 | 0.81 | DRD2 (0.53) | SMN1; SMN2ALDH1A1HPGDRAB9ADRD2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023116779-A1 | DIALKYNE COMPOUND AND USE THEREOF | 上海艾力斯医药科技股份有限公司 | 2023-06-29 | — | — | WO | disclosed |
| EP-4092024-A1 | PYRIMIDINE-4(3H)-KETONE HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF IN MEDICINE AND PHARMACOLOGY | Beijing InnoCare Pharma Tech Co., Ltd. (CN) | 2022-11-23 | — | — | EP | disclosed |