Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 4/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.52 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.52 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.52 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.52 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.52 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.52 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.52 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | HTR2A | P28223 | 4/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Biphenyl SCHEMBL10980681 | 0.84 | CHRNB2 (0.54) | MAOASLC6A2TAAR1SLC6A4SLC6A3 | |
| Biphenyl SCHEMBL27852646 | 0.84 | MAOA (0.52) | MAOASLC6A2TAAR1SLC6A4SLC6A3 | |
| Biphenyl SCHEMBL1556544 | 0.83 | ALDH1A1 (0.60) | MAOASLC6A2TAAR1SLC6A4SLC6A3 | |
| SCHEMBL21058269 | 0.83 | SLC6A2 (0.56) | MAOASLC6A2TAAR1SLC6A4SLC6A3 | |
| Biphenyl SCHEMBL14721190 | 0.82 | MAOA (0.50) | MAOASLC6A2TAAR1SLC6A4SLC6A3 | |
| Biphenyl SCHEMBL14721188 | 0.82 | MAOA (0.50) | MAOASLC6A2TAAR1SLC6A4SLC6A3 | |
| Biphenyl SCHEMBL27426704 | 0.80 | ALDH1A1 (0.56) | MAOASLC6A2TAAR1SLC6A4SLC6A3 | |
| SCHEMBL6014501 | 0.78 | TAAR1 (0.58) | MAOASLC6A2TAAR1SLC6A4SLC6A3 | |
| Biphenyl SCHEMBL28807835 | 0.78 | ADRA2A (0.54) | MAOASLC6A2TAAR1SLC6A4SLC6A3 | |
| SCHEMBL17413364 | 0.77 | TAAR1 (0.75) | MAOASLC6A2TAAR1SLC6A4SLC6A3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104193643-B | For the synthesis of the intermediate of anti-AIDS drug toughener cobicistat | NINGBO CHEMGOO PHARMACEUTICAL TECHNOLOGY INNOVATION LIMITED (CN) | 2016-02-10 | — | — | CN | claimed |
| CN-104193643-B | For the synthesis of the intermediate of anti-AIDS drug toughener cobicistat | NINGBO CHEMGOO PHARMACEUTICAL TECHNOLOGY INNOVATION LIMITED (CN) | 2016-02-10 | — | — | CN | disclosed |