Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.38 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.37 |
| ▸ | P2RX3 | P56373 | 2/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | CDK4 | P11802 | 1/20 | 0.35 |
| ▸ | CCND1 | P24385 | 1/20 | 0.35 |
| ▸ | CCND2 | P30279 | 1/20 | 0.35 |
| ▸ | CCND3 | P30281 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10562966 | 0.93 | TLR8 (0.41) | TLR8TLR7HPGDSMN1; SMN2ADORA3 | |
| SCHEMBL10562415 | 0.84 | TAAR1 (0.45) | ADORA2AADORA1HPGDSMN1; SMN2ADORA2B | |
| SCHEMBL9197469 | 0.83 | HPGD (0.51) | ADORA2AADORA1HPGDADORA3P2RX3 | |
| SCHEMBL10560450 | 0.82 | GSK3B (0.45) | ADORA2AADORA1HPGDSMN1; SMN2ADORA2B | |
| SCHEMBL10501681 | 0.81 | ALDH1A1 (0.41) | ADORA2AADORA1ADORA2BADORA3P2RX3 | |
| SCHEMBL10561004 | 0.76 | HPGD (0.49) | HPGDSMN1; SMN2ADORA3P2RX3BCHE | |
| SCHEMBL10332847 | 0.76 | CYP1A2 (0.42) | ADORA2ASMN1; SMN2 | |
| SCHEMBL10559101 | 0.73 | P2RX3 (0.47) | ADORA2AADORA1HPGDADORA2BADORA3 | |
| SCHEMBL10557859 | 0.72 | ADORA3 (0.46) | ADORA3P2RX3 | |
| SCHEMBL10562559 | 0.71 | KMT2A (0.47) | ADORA2AADORA1ADORA2BP2RX3 |
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 |