Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 13/20 | 0.81 |
| ▸ | KDM4E | B2RXH2 | 12/20 | 0.81 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.81 |
| ▸ | RAB9A | P51151 | 7/20 | 0.78 |
| ▸ | POLB | P06746 | 6/20 | 0.78 |
| ▸ | LMNA | P02545 | 5/20 | 0.78 |
| ▸ | GFER | P55789 | 1/20 | 0.78 |
| ▸ | HPGD | P15428 | 5/20 | 0.76 |
| ▸ | NPC1 | O15118 | 3/20 | 0.76 |
| ▸ | TP53 | P04637 | 1/20 | 0.76 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.71 |
| ▸ | MAPT | P10636 | 7/20 | 0.70 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.70 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.64 |
| ▸ | SMO | Q99835 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL25312016 | 1.00 | ALDH1A1 (0.81) | ALDH1A1KDM4ESMN1; SMN2RAB9APOLB | |
| SCHEMBL28933829 | 0.90 | ALDH1A1 (0.78) | ALDH1A1KDM4ESMN1; SMN2RAB9APOLB | |
| SCHEMBL1494696 | 0.87 | KDM4E (1.00) | ALDH1A1KDM4ESMN1; SMN2RAB9APOLB | |
| SCHEMBL13401433 | 0.85 | ALDH1A1 (0.77) | ALDH1A1KDM4ESMN1; SMN2RAB9APOLB | |
| SCHEMBL1494832 | 0.84 | KDM4E (0.83) | ALDH1A1KDM4ESMN1; SMN2RAB9APOLB | |
| SCHEMBL14076569 | 0.83 | KDM4E (0.72) | ALDH1A1KDM4ESMN1; SMN2RAB9APOLB | |
| SCHEMBL4727616 | 0.83 | KDM4E (0.82) | ALDH1A1KDM4ESMN1; SMN2RAB9APOLB | |
| SCHEMBL1494819 | 0.83 | ALDH1A1 (1.00) | ALDH1A1KDM4ESMN1; SMN2RAB9APOLB | |
| SCHEMBL4729920 | 0.83 | ALDH1A1 (1.00) | ALDH1A1KDM4ESMN1; SMN2RAB9APOLB | |
| SCHEMBL4726858 | 0.83 | SMN1; SMN2 (0.78) | ALDH1A1KDM4ESMN1; SMN2RAB9APOLB |
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-2022057932-A1 | CARBONYL HETEROCYCLIC COMPOUND AND APPLICATION THEREOF | 上海医药集团股份有限公司 | 2022-03-24 | — | — | WO | disclosed |
| WO-2022057928-A1 | CARBONYL HETEROCYCLIC COMPOUND AND APPLICATION THEREOF | 上海医药集团股份有限公司 | 2022-03-24 | — | — | WO | disclosed |