Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | TYK2 | P29597 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.35 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.35 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.35 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.35 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.35 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.35 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL14967094 | 0.82 | NAPRT (0.46) | NAPRTKDM4EKEAP1ALDH1A1GAA | |
| SCHEMBL1950385 | 0.75 | CYP1A2 (0.50) | NAPRTKDM4EALDH1A1KMT2AMAPT | |
| SCHEMBL14605312 | 0.75 | NAPRT (0.46) | NAPRTKDM4EKEAP1ALDH1A1KMT2A | |
| SCHEMBL5227532 | 0.75 | NAPRT (0.53) | NAPRTKDM4EKEAP1ALDH1A1KMT2A | |
| SCHEMBL22803201 | 0.72 | PARP1 (0.33) | KDM4EALDH1A1PRKAA1MAPTLMNA | |
| SCHEMBL6865182 | 0.72 | NAPRT (0.55) | NAPRTKDM4EKEAP1ALDH1A1KMT2A | |
| SCHEMBL26619127 | 0.72 | NAPRT (0.55) | NAPRTKDM4EKEAP1ALDH1A1KMT2A | |
| SCHEMBL3389839 | 0.71 | ALDH1A1 (0.52) | NAPRTKDM4EALDH1A1MAPTLMNA | |
| SCHEMBL27401155 | 0.71 | SIRT2 (0.38) | KMT2AMAPTPOLBPARP1 | |
| SCHEMBL22963000 | 0.71 | AURKA (0.43) | MAPTRECQLDYRK1APARP1 |
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-2595989-A1 | HETEROCYCLIC CHROMENE-SPIROCYCLIC PIPERIDINE AMIDES AS MODULATORS OF ION CHANNELS | Vertex Pharmaceuticals Incorporated (US) | 2013-05-29 | — | — | EP | disclosed |
| WO-2013067248-A1 | BENZOXAZINES AS MODULATORS OF ION CHANNELS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2013-05-10 | — | — | WO | disclosed |
| WO-2011140425-A1 | HETEROCYCLIC CHROMENE-SPIROCYCLIC PIPERIDINE AMIDES AS MODULATORS OF ION CHANNELS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2011-11-10 | — | — | WO | disclosed |