Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC9A1 | P19634 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 2/20 | 0.41 |
| ▸ | HTR2C | P28335 | 2/20 | 0.41 |
| ▸ | HTR2B | P41595 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.40 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | GPR88 | Q9GZN0 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8333596 | 0.85 | SLC9A1 (0.47) | SLC9A1HTR2AHTR2CHTR2BHTT | |
| SCHEMBL8333635 | 0.84 | HTR2A (0.44) | SLC9A1HTR2AHTR2CHTR2BHTT | |
| SCHEMBL8330285 | 0.82 | HSD17B1 (0.48) | SLC9A1HTR2AHTR2CHTR2BHSD17B1 | |
| SCHEMBL8332792 | 0.79 | HTR2A (0.43) | SLC9A1HTR2AHTR2CHTR2BHTT | |
| SCHEMBL8330750 | 0.71 | KDM1A (0.46) | GPR88 | |
| SCHEMBL1223671 | 0.70 | SLC9A1 (0.53) | SLC9A1HTR2AHTR2CHTR2BGPR88 | |
| SCHEMBL1223675 | 0.70 | SLC9A1 (0.53) | SLC9A1HTR2AHTR2CHTR2BGPR88 | |
| SCHEMBL13093203 | 0.69 | HTT (0.47) | SLC9A1HTTSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8331070 | 0.69 | HTR2C (0.44) | HTR2AHTR2CHTR2BMAOAGPR88 | |
| SCHEMBL24737783 | 0.68 | SLC9A1 (0.66) | SLC9A1HTR2AHTR2CHTR2BHTT |
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 |