Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.67 |
| ▸ | HPGD | P15428 | 4/20 | 0.67 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.67 |
| ▸ | GAA | P10253 | 2/20 | 0.66 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.60 |
| ▸ | RECQL | P46063 | 1/20 | 0.60 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | CNR1 | P21554 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL26603318 | 0.91 | ALDH1A1 (0.69) | ALDH1A1HPGDHSD17B10GAACYP1A2 | |
| SCHEMBL30626150 | 0.90 | GAA (0.80) | ALDH1A1HPGDHSD17B10GAACYP1A2 | |
| SCHEMBL26603300 | 0.90 | GAA (0.80) | ALDH1A1HPGDHSD17B10GAACYP1A2 | |
| SCHEMBL26603572 | 0.90 | ALDH1A1 (0.67) | ALDH1A1HPGDHSD17B10GAACYP1A2 | |
| SCHEMBL26603585 | 0.90 | ALDH1A1 (0.67) | ALDH1A1HPGDHSD17B10GAACYP1A2 | |
| SCHEMBL26603455 | 0.90 | ALDH1A1 (0.67) | ALDH1A1HPGDHSD17B10GAACYP1A2 | |
| SCHEMBL26603562 | 0.90 | ALDH1A1 (0.67) | ALDH1A1HPGDHSD17B10GAACYP1A2 | |
| SCHEMBL26603338 | 0.89 | ALDH1A1 (0.64) | ALDH1A1HPGDHSD17B10GAACYP1A2 | |
| SCHEMBL30709102 | 0.89 | GAA (0.68) | ALDH1A1HPGDHSD17B10GAACYP1A2 | |
| SCHEMBL26603461 | 0.89 | GAA (0.68) | ALDH1A1HPGDHSD17B10GAACYP1A2 |
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-2023202582-A1 | GPCR REGULATOR AND USE THEREOF | 北京昌平实验室 | 2023-10-26 | — | — | WO | disclosed |