Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.61 |
| ▸ | RAB9A | P51151 | 5/20 | 0.59 |
| ▸ | NPC1 | O15118 | 5/20 | 0.59 |
| ▸ | TP53 | P04637 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 8/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 3/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | RECQL | P46063 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.48 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL17844090 | 0.88 | ALDH1A1 (0.67) | HPGDALDH1A1RAB9ANPC1TP53 | |
| SCHEMBL18497701 | 0.87 | ALDH1A1 (0.63) | HPGDALDH1A1RAB9ANPC1TP53 | |
| SCHEMBL18172027 | 0.86 | MAPK14 (0.59) | HPGDALDH1A1RAB9ANPC1TP53 | |
| SCHEMBL18172002 | 0.81 | ALDH1A1 (0.72) | HPGDALDH1A1RAB9ANPC1TP53 | |
| SCHEMBL17844204 | 0.81 | ALDH1A1 (0.72) | HPGDALDH1A1RAB9ANPC1TP53 | |
| SCHEMBL18172095 | 0.80 | SCN9A (0.60) | HPGDALDH1A1MAPTSMN1; SMN2LMNA | |
| SCHEMBL13131101 | 0.79 | ALDH1A1 (0.69) | HPGDALDH1A1RAB9ANPC1TP53 | |
| SCHEMBL31117051 | 0.79 | ALDH1A1 (0.69) | HPGDALDH1A1RAB9ANPC1TP53 | |
| SCHEMBL3520425 | 0.79 | ALDH1A1 (0.69) | HPGDALDH1A1RAB9ANPC1TP53 | |
| SCHEMBL31116973 | 0.79 | ALDH1A1 (0.69) | HPGDALDH1A1RAB9ANPC1TP53 |
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-3286178-A1 | AMINO-SUBSTITUTED HETEROCYCLIC DERIVATIVES AS SODIUM CHANNEL INHIBITORS | Almirall S.A. (ES) | 2018-02-28 | — | — | EP | disclosed |
| WO-2016170009-A1 | AMINO-SUBSTITUTED HETEROCYCLIC DERIVATIVES AS SODIUM CHANNEL INHIBITORS | ALMIRALL, S.A. (ES) | 2016-10-27 | — | — | WO | disclosed |