Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.45 |
| ▸ | NOS1 | P29475 | 1/20 | 0.45 |
| ▸ | NOS2 | P35228 | 1/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.43 |
| ▸ | HSP90AB1 | P08238 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | NPY1R | P25929 | 1/20 | 0.43 |
| ▸ | NPY2R | P49146 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11062354 | 0.99 | SMN1; SMN2 (0.45) | NOS3NOS1NOS2HRH3HSP90AA1 | |
| SCHEMBL11066008 | 0.83 | NOS3 (0.51) | NOS3NOS1NOS2HRH3SMN1; SMN2 | |
| SCHEMBL11068948 | 0.81 | HRH1 (0.49) | NCEH1HTR1ASLC6A2SLC6A3HRH1 | |
| Hydrochloric Acid SCHEMBL11066756 | 0.79 | HRH1 (0.48) | NCEH1HTR1ASLC6A2SLC6A3HRH1 | |
| SCHEMBL11075243 | 0.75 | SMN1; SMN2 (0.55) | SMN1; SMN2KDM4ECYP2D6 | |
| SCHEMBL30656257 | 0.74 | SCD (0.53) | HRH3SMN1; SMN2KDM4ENPY1RNPY2R | |
| SCHEMBL10274501 | 0.74 | SCD (0.53) | HRH3SMN1; SMN2KDM4ENPY1RNPY2R | |
| SCHEMBL11065708 | 0.74 | HTR5A (0.46) | DRD3HTR2A | |
| SCHEMBL5408718 | 0.73 | AXL (0.44) | HRH3HSP90AA1HSP90AB1SMN1; SMN2KDM4E | |
| SCHEMBL5528217 | 0.73 | HRH3 (0.52) | NOS3NOS1NOS2HRH3SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4443462-A | Antipsychotic 4-(naphthalenyloxy)piperidine derivatives | MERRELL DOW PHARMACEUTICALS INC. (US) | 1984-04-17 | — | — | US | disclosed |