Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | PARP14 | Q460N5 | 5/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3659614 | 0.83 | PARP14 (0.47) | ALDH1A1SMN1; SMN2KDM4EPARP14HPGD | |
| SCHEMBL6326388 | 0.76 | ALDH1A1 (0.65) | ALDH1A1SMN1; SMN2KDM4EPARP14HPGD | |
| SCHEMBL10966556 | 0.73 | ALDH1A1 (0.53) | ALDH1A1SMN1; SMN2KDM4EPARP14HPGD | |
| SCHEMBL692795 | 0.72 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2KDM4EHPGDMAOA | |
| SCHEMBL5768691 | 0.71 | CYP2C19 (0.61) | ALDH1A1SMN1; SMN2KDM4EHPGDCYP2C19 | |
| SCHEMBL16429257 | 0.70 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2KDM4EPARP14HPGD | |
| SCHEMBL9871137 | 0.70 | ALDH1A1 (0.49) | ALDH1A1SMN1; SMN2KDM4EPARP14HPGD | |
| SCHEMBL5250996 | 0.69 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2KDM4EHPGDMAOA | |
| SCHEMBL5623725 | 0.69 | ALDH1A1 (0.71) | ALDH1A1SMN1; SMN2KDM4EPARP14HPGD | |
| SCHEMBL76190 | 0.69 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2KDM4EHPGDMAOA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1021392-B1 | PROCESSES FOR PRODUCING HYDROXYALDEHYDES | UNION CARBIDE CHEM PLASTIC (US) | 2002-12-18 | — | — | EP | disclosed |