Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.75 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.64 |
| ▸ | HPGD | P15428 | 5/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.61 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.57 |
| ▸ | RECQL | P46063 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 3/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 4/20 | 0.52 |
| ▸ | USP2 | O75604 | 2/20 | 0.52 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | CNR1 | P21554 | 1/20 | 0.50 |
| ▸ | CNR2 | P34972 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL26603519 | 1.00 | GAA (0.75) | GAAALDH1A1HPGDHSD17B10NR1H4 | |
| SCHEMBL26603300 | 0.93 | GAA (0.80) | GAAALDH1A1HPGDHSD17B10NR1H4 | |
| SCHEMBL30626150 | 0.93 | GAA (0.80) | GAAALDH1A1HPGDHSD17B10NR1H4 | |
| SCHEMBL30709171 | 0.89 | GAA (0.60) | GAAALDH1A1TSHRSMN1; SMN2TP53 | |
| SCHEMBL26603395 | 0.89 | GAA (0.60) | GAAALDH1A1TSHRSMN1; SMN2TP53 | |
| SCHEMBL26603458 | 0.85 | GAA (0.71) | GAAALDH1A1HPGDHSD17B10NR1H4 | |
| SCHEMBL26603532 | 0.85 | GAA (0.68) | GAAALDH1A1HPGDHSD17B10NR1H4 | |
| SCHEMBL26603495 | 0.84 | GAA (0.70) | GAAALDH1A1HPGDHSD17B10NR1H4 | |
| SCHEMBL26603318 | 0.84 | ALDH1A1 (0.69) | GAAALDH1A1HPGDHSD17B10NR1H4 | |
| SCHEMBL30709111 | 0.84 | GAA (0.66) | GAAALDH1A1HPGDHSD17B10NR1H4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116903563-A | GPCR modulators and uses thereof | 北京昌平实验室 | 2023-10-20 | — | — | CN | disclosed |