Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 3/20 | 0.40 |
| ▸ | NOS3 | P29474 | 2/20 | 0.40 |
| ▸ | BCHE | P06276 | 3/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9617160 | 0.76 | PRCP (0.47) | NOS3ALDH1A1MAPTKDM4EMEN1 | |
| Hydrochloric Acid SCHEMBL9582716 | 0.75 | PRCP (0.46) | NOS3ALDH1A1MAPTKDM4EMEN1 | |
| SCHEMBL8945868 | 0.74 | BCHE (0.39) | NOS2NOS3BCHESLC6A2SLC6A4 | |
| SCHEMBL28923871 | 0.70 | AR (0.45) | NOS2NOS3SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8946067 | 0.69 | TSHR (0.40) | NOS2NOS3MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL8946093 | 0.69 | SLC6A2 (0.41) | NOS2NOS3BCHESLC6A2SLC6A4 | |
| SCHEMBL2376720 | 0.66 | KDM4E (0.54) | NOS2NOS3ALDH1A1MAPTKDM4E | |
| SCHEMBL11471110 | 0.64 | MAPT (0.51) | NOS2NOS3BCHESLC6A2SLC6A4 | |
| SCHEMBL20041750 | 0.64 | TRPA1 (0.35) | TRPA1 | |
| SCHEMBL8945774 | 0.62 | SLC6A2 (0.40) | NOS2NOS3BCHESLC6A2SLC6A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5510346-A | ANTIDEPRESSANTS, ANTIANXIETY AGENTS | HOECHST MARION ROUSSEL, INC. (US) | 1996-04-23 | — | — | US | disclosed |
| US-5292760-A | 4-heteroaryl-1,3-benzodiazepines and 2-substituted-α-(heteroaryl)benzeneethanamines | HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) | 1994-03-08 | — | — | US | disclosed |
| EP-0322582-A2 | 4-Heteroaryl-1,3-Benzodiazepines and 2-substituted-alpha-(heteroaryl)benzeneethanamines, a process for their preparation and their use us medicaments | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1989-07-05 | — | — | EP | disclosed |