Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.37 |
| ▸ | ABAT | P80404 | 1/20 | 0.37 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.35 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.35 |
| ▸ | CDK1 | P06493 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | TYR | P14679 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | HTR3A | P46098 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL15452989 | 0.83 | ALDH1A1 (0.47) | ALDH1A1LMNAMAPTHPGDSMN1; SMN2 | |
| SCHEMBL28324720 | 0.81 | CDK1 (0.48) | ALDH1A1LMNAMAPTHPGDSMN1; SMN2 | |
| SCHEMBL5429778 | 0.78 | CYP2A6 (0.50) | ALDH1A1LMNAMAPTHPGDSMN1; SMN2 | |
| SCHEMBL3012913 | 0.75 | ALDH1A1 (0.46) | ALDH1A1LMNAMAPTHPGDSMN1; SMN2 | |
| SCHEMBL2457708 | 0.75 | CA2 (0.50) | ALDH1A1LMNAMAPTHPGDSMN1; SMN2 | |
| SCHEMBL13825066 | 0.75 | CYP1A2 (0.46) | ALDH1A1CYP2A6KMT2ACA1CA2 | |
| SCHEMBL219423 | 0.75 | ALDH1A1 (0.52) | ALDH1A1LMNAMAPTHPGDSMN1; SMN2 | |
| SCHEMBL12344758 | 0.75 | MAOA (0.45) | ALDH1A1LMNAMAPTHPGDSMN1; SMN2 | |
| SCHEMBL17278365 | 0.75 | ALDH1A1 (0.54) | ALDH1A1MAPTSMN1; SMN2CYP2A6 | |
| SCHEMBL17906209 | 0.75 | ALDH1A1 (0.42) | ALDH1A1LMNAMAPTHPGDSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-11298694-B2 | Zwitterion-ruthenium complex for catalytic aerobic oxidation reactions | THE CHINESE UNIVERSITY OF HONG KONG (CN) | 2022-04-12 | — | — | US | disclosed |
| US-20210121862-A1 | ZWITTERION-RUTHENIUM COMPLEX FOR CATALYTIC AEROBIC OXIDATION REACTIONS | THE CHINESE UNIVERSITY OF HONG KONG (CN) | 2021-04-29 | — | — | US | disclosed |