Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.40 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.40 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.40 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.40 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9901465 | 0.95 | MEN1 (0.43) | MEN1HTTKMT2ANPC1RAB9A | |
| SCHEMBL9902660 | 0.75 | TBXA2R (0.43) | NPC1RAB9AALDH1A1PKMLMNA | |
| SCHEMBL9902597 | 0.74 | GRIN2D (0.47) | MEN1HTTKMT2ANPC1RAB9A | |
| SCHEMBL9902992 | 0.71 | ALDH1A1 (0.51) | MEN1HTTKMT2ANPC1RAB9A | |
| SCHEMBL9565723 | 0.71 | NPC1 (0.55) | MEN1KMT2ANPC1RAB9AADRA2A | |
| SCHEMBL9901561 | 0.70 | GRIN2D (0.42) | MEN1KMT2ANPC1RAB9AADRA2A | |
| SCHEMBL9902971 | 0.69 | ROCK2 (0.36) | MEN1HTTKMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL9901463 | 0.68 | ALDH1A1 (0.53) | MEN1HTTKMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL9902117 | 0.67 | ALDH1A1 (0.46) | MEN1HTTKMT2ANPC1RAB9A | |
| SCHEMBL3671286 | 0.66 | HPGD (0.65) | NPC1RAB9AALDH1A1SMN1; SMN2PKM |
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-2649048-A1 | MULTIFUNCTIONAL NITROXIDE DERIVATIVES AND USES THEREOF | Radikal Therapeutics Inc. (US) | 2013-10-16 | — | — | EP | disclosed |
| WO-2012077108-A1 | MULTIFUNCTIONAL NITROXIDE DERIVATIVES AND USES THEREOF | RADIKAL THERAPEUTICS INC. (US) | 2012-06-14 | — | — | WO | disclosed |