Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 4/20 | 0.35 |
| ▸ | RAB9A | P51151 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 3/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | TDO2 | P48775 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19331127 | 0.85 | ALDH1A1 (0.38) | KMT2AALDH1A1HTTKIF11NPC1 | |
| SCHEMBL30262599 | 0.83 | IDO1 (0.43) | KMT2AALDH1A1HTTKIF11MEN1 | |
| SCHEMBL10129973 | 0.83 | IDO1 (0.43) | KMT2AALDH1A1HTTKIF11MEN1 | |
| SCHEMBL28439006 | 0.79 | L3MBTL1 (0.44) | ALDH1A1HTTRAB9AMAPTSMN1; SMN2 | |
| SCHEMBL30387764 | 0.79 | L3MBTL1 (0.44) | ALDH1A1HTTRAB9AMAPTSMN1; SMN2 | |
| SCHEMBL23043120 | 0.77 | KMT2A (0.49) | KMT2AALDH1A1HTTNPC1RAB9A | |
| SCHEMBL3475291 | 0.77 | SLC2A1 (0.42) | KMT2AALDH1A1HTTNPC1RAB9A | |
| SCHEMBL20577762 | 0.77 | HDAC1 (0.37) | KMT2AALDH1A1NPC1RAB9AMEN1 | |
| SCHEMBL20721915 | 0.76 | HDAC1 (0.40) | KMT2AALDH1A1NPC1RAB9AMEN1 | |
| SCHEMBL6523050 | 0.75 | ATR (0.40) | KMT2AHTTNPC1RAB9AMEN1 |
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-2470528-A1 | COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS | Novartis AG (CH) | 2012-07-04 | — | — | EP | disclosed |
| WO-2011023773-A1 | COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS | NOVARTIS AG (CH) | 2011-03-03 | — | — | WO | disclosed |