Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.41 |
| ▸ | PNMT | P11086 | 1/20 | 0.39 |
| ▸ | KIF11 | P52732 | 1/20 | 0.39 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.39 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.39 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.39 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.39 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 2/20 | 0.38 |
| ▸ | NOS2 | P35228 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10338275 | 0.85 | TAAR1 (0.55) | TAAR1SLC6A2SIGMAR1MAOASLC6A4 | |
| SCHEMBL29342899 | 0.84 | TAAR1 (0.43) | TAAR1SLC6A2SIGMAR1MAOASLC6A4 | |
| SCHEMBL7887272 | 0.84 | TAAR1 (0.43) | TAAR1SLC6A2SIGMAR1MAOASLC6A4 | |
| SCHEMBL11797022 | 0.84 | CTSS (0.43) | SIGMAR1KIF11GRIN2DGRIN3BGRIN1 | |
| SCHEMBL26008372 | 0.84 | TAAR1 (0.43) | TAAR1SLC6A2SIGMAR1MAOASLC6A4 | |
| SCHEMBL9784597 | 0.83 | CYP4F2 (0.44) | TAAR1SLC6A2SIGMAR1MAOASLC6A4 | |
| SCHEMBL25112424 | 0.83 | CYP4F2 (0.44) | TAAR1SLC6A2SIGMAR1MAOASLC6A4 | |
| SCHEMBL7029063 | 0.81 | SLC6A2 (0.47) | TAAR1SLC6A2SIGMAR1MAOASLC6A4 | |
| SCHEMBL3029503 | 0.81 | KDM4E (0.45) | TAAR1SIGMAR1GRIN2DGRIN3BGRIN1 | |
| SCHEMBL3029500 | 0.81 | DAO (0.39) | SIGMAR1KIF11GRIN2DGRIN3BGRIN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022076622-A2 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |