Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | OGG1 | O15527 | 1/20 | 0.45 |
| ▸ | PGR | P06401 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL12116456 | 0.88 | ALDH1A1 (0.55) | TSHRKDM4EALDH1A1HPGDTDP1 | |
| SCHEMBL12115952 | 0.87 | CNR2 (0.48) | TSHRKDM4EALDH1A1HPGDTDP1 | |
| SCHEMBL3816749 | 0.77 | ALDH1A1 (0.55) | TSHRKDM4EALDH1A1HPGDTDP1 | |
| SCHEMBL3816745 | 0.77 | ALDH1A1 (0.55) | TSHRKDM4EALDH1A1HPGDTDP1 | |
| SCHEMBL12113399 | 0.76 | ALDH1A1 (0.53) | TSHRKDM4EALDH1A1HPGDTDP1 | |
| SCHEMBL31404067 | 0.75 | KDM4E (0.62) | TSHRKDM4EALDH1A1HPGDTDP1 | |
| SCHEMBL1308527 | 0.74 | HPGD (0.49) | TSHRKDM4EALDH1A1HPGDTDP1 | |
| SCHEMBL1306558 | 0.74 | CNR2 (0.47) | TSHRKDM4EALDH1A1HPGDTDP1 | |
| SCHEMBL1308523 | 0.74 | HPGD (0.49) | TSHRKDM4EALDH1A1HPGDTDP1 | |
| SCHEMBL1306561 | 0.74 | CNR2 (0.47) | TSHRKDM4EALDH1A1HPGDTDP1 |
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-3875081-A1 | PHARMACEUTICAL COMPOSITION CONTAINING ALKYL CARBAMOYL NAPHTHALENYLOXY OCTENOYL HYDROXYAMIDE PHOSPHATE, TARTRATE OR COMBINATION THEREOF, AND PREPARATION METHOD THEREFOR | Crystalgenomics, Inc. (KR) | 2021-09-08 | — | — | EP | disclosed |