Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 2/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.40 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.40 |
| ▸ | TMIGD3 | P0DMS9 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GSK3A | P49840 | 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 | |
|---|---|---|---|---|
| SCHEMBL10562415 | 0.92 | TAAR1 (0.45) | GSK3BTAAR1L3MBTL1ADORA2AADORA2B | |
| SCHEMBL9197469 | 0.86 | HPGD (0.51) | ADORA2AADORA1HPGD | |
| SCHEMBL10332847 | 0.84 | CYP1A2 (0.42) | GSK3BADRA2AL3MBTL1ADORA2ASMN1; SMN2 | |
| SCHEMBL10501681 | 0.84 | ALDH1A1 (0.41) | ADORA2AADORA2BADORA1ALDH1A1 | |
| SCHEMBL10561004 | 0.84 | HPGD (0.49) | GSK3BADRA2ABCHEACHEL3MBTL1 | |
| SCHEMBL10557480 | 0.82 | TLR8 (0.38) | TAAR1BCHEACHEADORA2AADORA2B | |
| SCHEMBL10562966 | 0.80 | TLR8 (0.41) | ADRA2ATAAR1BCHEACHEL3MBTL1 | |
| SCHEMBL4668715 | 0.77 | CACNA1G (0.50) | GSK3BL3MBTL1ADORA2AADORA2BADORA1 | |
| SCHEMBL10559101 | 0.76 | P2RX3 (0.47) | ADORA2AADORA2BADORA1HPGDLMNA | |
| SCHEMBL10557859 | 0.75 | ADORA3 (0.46) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4824848-A | TREATMENT, PREVENTION OF NERVOUS SYSTEM DISORDERS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1989-04-25 | — | — | US | disclosed |
| EP-0237289-A2 | Pyrazolo [3,4-d] pyrimidine derivatives, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1987-09-16 | — | — | EP | disclosed |