Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | MGLL | Q99685 | 1/20 | 0.41 |
| ▸ | MPO | P05164 | 2/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.40 |
| ▸ | IAPP | P10997 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | BID | P55957 | 3/20 | 0.36 |
| ▸ | BCL2L1 | Q07817 | 3/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 3/20 | 0.36 |
| ▸ | BAK1 | Q16611 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7332508 | 0.79 | MPO (0.46) | TAAR1MGLLMPOSLC6A4HTR1A | |
| SCHEMBL28957063 | 0.79 | MPO (0.49) | TAAR1MGLLMPOSLC6A4HTR1A | |
| SCHEMBL11581696 | 0.78 | HTR1A (0.49) | TAAR1MGLLMPOSLC6A4HTR1A | |
| SCHEMBL4984834 | 0.77 | TAAR1 (0.42) | TAAR1MGLLMPOSLC6A4AKR1B1 | |
| SCHEMBL678668 | 0.77 | MPO (0.50) | TAAR1MGLLMPOSLC6A4HTR1A | |
| SCHEMBL27530341 | 0.77 | TAAR1 (0.55) | TAAR1MGLLMPOSLC6A4AKR1B1 | |
| SCHEMBL6570739 | 0.76 | HTR1A (0.47) | TAAR1MGLLMPOSLC6A4HTR1A | |
| Isobutyramide SCHEMBL28186861 | 0.76 | BID (0.49) | TAAR1MGLLMPOSLC6A4AKR1B1 | |
| SCHEMBL27665209 | 0.76 | TAAR1 (0.38) | TAAR1MGLLMPOSLC6A4AKR1B1 | |
| SCHEMBL661213 | 0.76 | TSHR (0.51) | — |
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-5661185-A | AN ALKOXYPHENYL-ALKYLUREA COMPOUND TREATING SLEEP DISORDER | BRISTOL-MYERS SQUIBB CO. (US) | 1997-08-26 | — | — | US | disclosed |
| US-5541228-A | Melatonergic agents | BRISTOL-MYERS SQUIBB CO. (US) | 1996-07-30 | — | — | US | disclosed |
| EP-0706994-A1 | Melatonergic agents | BRISTOL-MYERS SQUIBB COMPANY (US) | 1996-04-17 | — | — | EP | disclosed |