Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 7/20 | 0.40 |
| ▸ | DRD3 | P35462 | 4/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.37 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 3/20 | 0.34 |
| ▸ | HTR2C | P28335 | 2/20 | 0.34 |
| ▸ | DRD4 | P21917 | 2/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
| ▸ | MC4R | P32245 | 1/20 | 0.33 |
| ▸ | LTA4H | P09960 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9699278 | 0.89 | NOTUM (0.36) | DRD2NOTUMHRH3DRD4 | |
| SCHEMBL9701602 | 0.89 | ADRA2A (0.38) | DRD2NOTUMHRH3DRD4LTA4H | |
| SCHEMBL9699340 | 0.85 | CYP2A13 (0.39) | DRD2DRD3NOTUMDRD4 | |
| SCHEMBL9701449 | 0.83 | DRD2 (0.41) | DRD2DRD3NOTUMHTR2AHTR2C | |
| SCHEMBL9699337 | 0.83 | ADRA2A (0.42) | DRD2DRD3HRH3HTR2AHTR2C | |
| SCHEMBL9699323 | 0.81 | CXCR4 (0.36) | DRD2DRD3HRH3HTR2AHTR2C | |
| SCHEMBL9699269 | 0.79 | NOTUM (0.38) | DRD2NOTUMHTR2AHTR2C | |
| SCHEMBL9700368 | 0.77 | NOTUM (0.37) | NOTUM | |
| SCHEMBL9701322 | 0.76 | HRH3 (0.43) | DRD2DRD3HRH4HRH3HTR2A | |
| SCHEMBL9701613 | 0.73 | ADRA2A (0.41) | DRD2DRD3HTR2AHTR2CDRD4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5109135-A | 2- or 3-aminomethyl-4-amino-3,4-dihydro-2H-1,4-benzoxazine intermediates | STERLING DRUG INC. (US) | 1992-04-28 | — | — | US | disclosed |
| US-5066803-A | Chemical intermediates for analgesics | STERLING DRUG INC. (US) | 1991-11-19 | — | — | US | disclosed |
| WO-1990007505-A1 | 2- AND 3-AMINOMETHYL-6-ARYLCARBONYL-2,3-DIHYDROPYRROLO[1,2,3-de]-1,4-BENZOXAZINES | STERLING DRUG INC. (US) | 1990-07-12 | — | — | WO | disclosed |
| US-4939138-A | 2- and 3-aminomethyl-6-arylcarbonyl-2,3-dihydropyrrolo(1,2,3-DE)-1,4-benzoxazines | STERLING DRUG INC. (US) | 1990-07-03 | — | — | US | disclosed |