Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | MITF | O75030 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | GFER | P55789 | 1/20 | 0.46 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.44 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL11927945 | 0.98 | ALDH1A1 (0.47) | ALDH1A1HTTMITFRAB9AGFER | |
| SCHEMBL16509775 | 0.84 | GAA (0.63) | ALDH1A1GFERPOLBCYP2D6KCNH2 | |
| SCHEMBL7155342 | 0.83 | MEN1 (0.55) | ALDH1A1CYP2D6CYP3A4CYP2C19CYP1A2 | |
| SCHEMBL8744393 | 0.83 | CYP1A2 (0.45) | ALDH1A1RAB9AATMCYP2D6CYP3A4 | |
| SCHEMBL13572993 | 0.83 | SIGMAR1 (0.49) | KCNH2GAAMEN1KMT2A | |
| SCHEMBL12513625 | 0.83 | POLB (0.51) | ALDH1A1PAX8ATMSMN1; SMN2POLB | |
| SCHEMBL13039127 | 0.81 | ALDH1A1 (0.50) | ALDH1A1HTTMITFRAB9AGFER | |
| SCHEMBL13039121 | 0.81 | ALDH1A1 (0.43) | ALDH1A1HTTMITFRAB9AGFER | |
| SCHEMBL13039128 | 0.81 | ALDH1A1 (0.50) | ALDH1A1HTTMITFRAB9AGFER | |
| SCHEMBL13039130 | 0.81 | ALDH1A1 (0.43) | ALDH1A1HTTMITFRAB9AGFER |
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 |
|---|---|---|---|---|---|---|---|
| EP-2474527-A1 | IONIC LIQUID CONTAINING ALLYLSULFONATE ANION | Wako Pure Chemical Industries, Ltd. (JP) | 2012-07-11 | — | — | EP | disclosed |
| US-20010047097-A1 | Process for the preparation of arylethylamines by amination of arylolefins | AVENTIS RESEARCH & TECHNOLOGIES GMBH & CO KG (DE) | 2001-11-29 | — | — | US | disclosed |
| EP-1157983-A1 | Process for the preparation of arylethylamines via the amination of arylolefins | Aventis Research & Technologies GmbH & Co KG (DE) | 2001-11-28 | — | — | EP | disclosed |