Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 5/20 | 0.51 |
| ▸ | HTR2A | P28223 | 1/20 | 0.51 |
| ▸ | HTR2B | P41595 | 1/20 | 0.51 |
| ▸ | MTNR1A | P48039 | 6/20 | 0.49 |
| ▸ | MTNR1B | P49286 | 6/20 | 0.49 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 2/20 | 0.41 |
| ▸ | DRD1 | P21728 | 2/20 | 0.41 |
| ▸ | DRD4 | P21917 | 2/20 | 0.41 |
| ▸ | DRD3 | P35462 | 2/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | GPR88 | Q9GZN0 | 1/20 | 0.38 |
| ▸ | NOS3 | P29474 | 1/20 | 0.38 |
| ▸ | NOS1 | P29475 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8098166 | 1.00 | HTR2C (0.51) | HTR2CHTR2AHTR2BMTNR1AMTNR1B | |
| SCHEMBL8088677 | 0.86 | HTR2C (0.52) | HTR2CHTR2AHTR2BMTNR1AMTNR1B | |
| SCHEMBL8088680 | 0.86 | HTR2C (0.52) | HTR2CHTR2AHTR2BMTNR1AMTNR1B | |
| SCHEMBL8102256 | 0.84 | HTR2C (0.54) | HTR2CHTR2AHTR2BMTNR1AMTNR1B | |
| SCHEMBL8102259 | 0.84 | HTR2C (0.54) | HTR2CHTR2AHTR2BMTNR1AMTNR1B | |
| SCHEMBL8088503 | 0.82 | HTR2A (0.56) | HTR2CHTR2AHTR2BMTNR1AMTNR1B | |
| SCHEMBL8088502 | 0.82 | HTR2A (0.56) | HTR2CHTR2AHTR2BMTNR1AMTNR1B | |
| SCHEMBL8088842 | 0.81 | MTNR1B (0.51) | HTR2CHTR2AHTR2BMTNR1AMTNR1B | |
| SCHEMBL8088845 | 0.81 | MTNR1B (0.51) | HTR2CHTR2AHTR2BMTNR1AMTNR1B | |
| SCHEMBL14568837 | 0.78 | HTR2C (0.65) | HTR2CHTR2AHTR2BNOS3NOS1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0747346-B1 | N-acyl-2 aryl cyclopropylmethylamine derivatives as melatonergics | BRISTOL MYERS SQUIBB CO (US) | 2000-02-16 | — | — | EP | disclosed |
| EP-0747346-A2 | N-acyl-2 aryl cyclopropylmethylamine derivatives as melatonergics | BRISTOL-MYERS SQUIBB COMPANY (US) | 1996-12-11 | — | — | EP | disclosed |