Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.56 |
| ▸ | MPO | P05164 | 3/20 | 0.46 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 2/20 | 0.42 |
| ▸ | MAOB | P27338 | 3/20 | 0.39 |
| ▸ | DAO | P14920 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GLS | O94925 | 1/20 | 0.38 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.38 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.38 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8072531 | 0.98 | TAAR1 (0.54) | TAAR1MPOAOC3SLC6A4IDO1 | |
| SCHEMBL8075974 | 0.98 | TAAR1 (0.54) | TAAR1MPOAOC3SLC6A4IDO1 | |
| SCHEMBL8072834 | 0.98 | TAAR1 (0.54) | TAAR1MPOAOC3SLC6A4IDO1 | |
| SCHEMBL7564094 | 0.98 | TAAR1 (0.54) | TAAR1MPOAOC3SLC6A4IDO1 | |
| SCHEMBL8073101 | 0.98 | TAAR1 (0.54) | TAAR1MPOAOC3SLC6A4IDO1 | |
| SCHEMBL8073119 | 0.98 | TAAR1 (0.54) | TAAR1MPOAOC3SLC6A4IDO1 | |
| SCHEMBL79807 | 0.93 | TAAR1 (0.58) | TAAR1MPOAOC3SLC6A4IDO1 | |
| SCHEMBL459369 | 0.84 | TAAR1 (0.62) | TAAR1MPOAOC3IDO1MAOB | |
| SCHEMBL29447918 | 0.84 | TAAR1 (0.62) | TAAR1MPOAOC3IDO1MAOB | |
| SCHEMBL9585312 | 0.84 | TAAR1 (0.44) | TAAR1MPOAOC3SLC6A4IDO1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016100823-A1 | DOPAMINE D2 RECEPTOR LIGANDS | THE BROAD INSTITUTE, INC. (US) | 2016-06-23 | — | — | WO | disclosed |
| CN-101730677-A | Amine compound and pharmaceutical use thereof | MITSUBISHI TANABE PHARMA CORP | 2010-06-09 | — | — | CN | disclosed |
| US-6063940-A | Process for preparing 1-bromoalkylbenzene derivatives and intermediates thereof | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2000-05-16 | — | — | US | disclosed |
| US-5637736-A | Process for preparing 1-bromoalkylbenzene derivatives and intermediates thereof | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1997-06-10 | — | — | US | disclosed |
| EP-0637580-A1 | Process for preparing 1-bromoalkylbenzene derivatives and intermediates thereof | SUMITOMO CHEMICAL COMPANY LIMITED (JP) | 1995-02-08 | — | — | EP | disclosed |