Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.37 |
| ▸ | C1S | P09871 | 1/20 | 0.37 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 2/20 | 0.35 |
| ▸ | AGXT | P21549 | 2/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 2/20 | 0.34 |
| ▸ | MGLL | Q99685 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1768568 | 0.86 | — | — | |
| SCHEMBL18173351 | 0.80 | ALDH1A1 (0.50) | ALDH1A1MAPK1TAAR1C1SPARP1 | |
| SCHEMBL5000 | 0.80 | — | — | |
| SCHEMBL28529906 | 0.78 | ALDH1A1 (0.40) | ALDH1A1MAPK1NPC1RAB9ATP53 | |
| Benzene SCHEMBL25214246 | 0.76 | ALDH1A1 (0.60) | ALDH1A1MAPK1TAAR1C1SPARP1 | |
| SCHEMBL30607060 | 0.76 | — | — | |
| SCHEMBL9581517 | 0.76 | — | — | |
| SCHEMBL11291671 | 0.74 | CYP2A6 (0.57) | ALDH1A1MAPK1TAAR1C1SPARP1 | |
| Ethylene SCHEMBL27459981 | 0.74 | ALDH1A1 (0.55) | ALDH1A1MAPK1TAAR1C1SPARP1 | |
| SCHEMBL30268524 | 0.72 | — | — |
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-2069272-A1 | PROCESS FOR THE SYNTHESIS OF 2,2',6-TRIBROMOBIPHENYL | LONZA AG (CH) | 2009-06-17 | — | — | EP | disclosed |
| WO-2008037440-A1 | PROCESS FOR THE SYNTHESIS OF 2,2',6-TRIBROMOBIPHENYL | LONZA AG (CH) | 2008-04-03 | — | — | WO | disclosed |