Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8330943 | 1.00 | MAOA (0.49) | MAOATP53DRD2OPRM1DRD3 | |
| SCHEMBL8331482 | 0.85 | HTR2C (0.43) | DRD2OPRM1DRD3 | |
| SCHEMBL8331359 | 0.85 | HTR2A (0.43) | DRD2OPRM1DRD3 | |
| SCHEMBL8331603 | 0.85 | HTR2A (0.43) | MAOADRD2DRD3 | |
| SCHEMBL8332820 | 0.84 | KDM1A (0.43) | DRD2DRD3HRH3 | |
| SCHEMBL8469011 | 0.84 | SLC5A1 (0.41) | MAOAOPRM1SIGMAR1SMN1; SMN2 | |
| SCHEMBL8332792 | 0.84 | HTR2A (0.43) | TP53DRD2DRD3 | |
| SCHEMBL8469013 | 0.84 | SLC5A1 (0.41) | MAOAOPRM1SIGMAR1SMN1; SMN2 | |
| SCHEMBL8332882 | 0.82 | HTR2A (0.47) | DRD2SIGMAR1 | |
| SCHEMBL8329351 | 0.82 | HTR2A (0.47) | DRD2SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5889031-A | CONTROLLING CIRCADIAN RHYTHMS | BRISTOL-MYERS SQUIBB COMPNAY (US) | 1999-03-30 | — | — | US | disclosed |
| US-5753709-A | N-acyl-2 aryl cyclopropylmethylamine derivatives as melatonergics | BRISTOL-MYERS SQUIBB COMPANY (US) | 1998-05-19 | — | — | US | disclosed |