Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.53 |
| ▸ | BACE1 | P56817 | 1/20 | 0.43 |
| ▸ | PRNP | P04156 | 1/20 | 0.43 |
| ▸ | AURKA | O14965 | 2/20 | 0.43 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.43 |
| ▸ | KDR | P35968 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.40 |
| ▸ | DHODH | Q02127 | 3/20 | 0.40 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | APP | P05067 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL28536639 | 0.89 | PDE10A (0.69) | PDE10APRNPAURKBMAPTALDH1A1 | |
| SCHEMBL28853907 | 0.86 | PDE10A (0.74) | PDE10APRNPMAPTALDH1A1TDP1 | |
| SCHEMBL8733061 | 0.85 | DHODH (0.53) | PDE10AAKR1B10DHODH | |
| SCHEMBL12578166 | 0.79 | MAPK14 (0.56) | PDE10AAURKAAURKBMAPTALDH1A1 | |
| SCHEMBL11872346 | 0.79 | TDP1 (0.62) | PDE10ABACE1ALDH1A1HTTPSMB5 | |
| SCHEMBL4143806 | 0.77 | PDE10A (0.56) | PDE10ABACE1MAPTALDH1A1MAPK1 | |
| SCHEMBL1128599 | 0.76 | BACE1 (0.44) | BACE1MAPTALDH1A1HTTSMN1; SMN2 | |
| SCHEMBL789778 | 0.76 | BACE1 (0.53) | BACE1MAPTALDH1A1HTTPSMB5 | |
| SCHEMBL12317094 | 0.74 | ALDH1A1 (0.68) | AURKAAURKBKDRMAPTALDH1A1 | |
| SCHEMBL22804126 | 0.74 | NPC1 (0.39) | PDE10AMAPTALDH1A1MAPK1HTT |
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-112521333-A | Synthesis method of chiral 2, 3-disubstituted tetrahydroquinoline derivative | 中国科学院大连化学物理研究所 | 2021-03-19 | — | — | CN | disclosed |