Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | GMNN | O75496 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | GSR | P00390 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | APP | P05067 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10601165 | 1.00 | ALDH1A1 (0.42) | ALDH1A1LMNAKDM4EGMNNPOLB | |
| SCHEMBL10598148 | 1.00 | ALDH1A1 (0.42) | ALDH1A1LMNAKDM4EGMNNPOLB | |
| SCHEMBL10598468 | 1.00 | ALDH1A1 (0.42) | ALDH1A1LMNAKDM4EGMNNPOLB | |
| SCHEMBL10598153 | 1.00 | ALDH1A1 (0.42) | ALDH1A1LMNAKDM4EGMNNPOLB | |
| SCHEMBL1348081 | 0.75 | ADRA2C (0.45) | ALDH1A1LMNAKDM4EGMNNPOLB | |
| Nitric Acid SCHEMBL9838314 | 0.74 | ALDH1A1 (0.47) | ALDH1A1LMNAKDM4EKMT2AGSR | |
| SCHEMBL9793652 | 0.73 | ALDH1A1 (0.38) | ALDH1A1LMNAKDM4EMAPTKMT2A | |
| SCHEMBL8670434 | 0.72 | KDM4E (0.50) | ALDH1A1LMNAKDM4EGMNNPOLB | |
| SCHEMBL1357640 | 0.72 | KDM4E (0.50) | ALDH1A1LMNAKDM4EGMNNPOLB | |
| SCHEMBL10866061 | 0.72 | CES2 (0.42) | ALDH1A1LMNAKDM4EKMT2AGSR |
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 |
|---|---|---|---|---|---|---|---|
| EP-0222292-B1 | FLUORINATED NITRO- AND AMINOALCOHOLS | BAYER AG (DE) | 1989-06-21 | — | — | EP | disclosed |
| US-4778935-A | INSECTICIDES, CHEMICAL INTERMEDIATES | BAYER AKTIENGESELLSCHAFT (DE) | 1988-10-18 | — | — | US | disclosed |