Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | SYK | P43405 | 5/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | KMO | O15229 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 2/20 | 0.38 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.38 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL839778 | 0.82 | VCP (0.43) | ALDH1A1KDM4EHPGDTSHRLMNA | |
| Hydrochloric Acid SCHEMBL832239 | 0.82 | VCP (0.42) | ALDH1A1KDM4EHPGDTSHRLMNA | |
| SCHEMBL840345 | 0.82 | ALDH1A1 (0.41) | ALDH1A1L3MBTL1KMOAKR1B10AKR1C4 | |
| Hydrochloric Acid SCHEMBL832126 | 0.81 | ALDH1A1 (0.40) | ALDH1A1L3MBTL1KMOAKR1B10AKR1C4 | |
| SCHEMBL832422 | 0.81 | KMO (0.45) | ALDH1A1KDM4EHPGDTSHRLMNA | |
| SCHEMBL839415 | 0.77 | KMO (0.42) | ALDH1A1KDM4EHPGDTSHRLMNA | |
| SCHEMBL839602 | 0.77 | ALDH1A1 (0.42) | ALDH1A1KDM4EHPGDTSHRLMNA | |
| SCHEMBL830345 | 0.77 | ALDH1A1 (0.42) | ALDH1A1L3MBTL1KMOAKR1B10AKR1C4 | |
| Hydrochloric Acid SCHEMBL832585 | 0.77 | KMO (0.41) | ALDH1A1KDM4EHPGDTSHRLMNA | |
| SCHEMBL829626 | 0.76 | ALDH1A1 (0.50) | ALDH1A1KDM4EHPGDLMNAL3MBTL1 |
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-2009033561-A1 | SUBSTITUTED 6-PHEYLNICOTINIC ACIDS AND THE USE THEREOF | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2009-03-19 | — | — | WO | disclosed |