Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 7/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.55 |
| ▸ | MAPT | P10636 | 5/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.44 |
| ▸ | HTR3B | O95264 | 1/20 | 0.44 |
| ▸ | HTR3A | P46098 | 1/20 | 0.44 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.44 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.43 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | IGF1R | P08069 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL173758 | 0.88 | SMN1; SMN2 (0.53) | MEN1KMT2AMAPTHTTALDH1A1 | |
| SCHEMBL167730 | 0.87 | MEN1 (0.57) | MEN1KMT2AMAPTALDH1A1KDM4E | |
| Trifluoroacetic Acid SCHEMBL167491 | 0.83 | KMT2A (0.50) | MEN1KMT2AMAPTALDH1A1KDM4E | |
| SCHEMBL15077842 | 0.80 | IGF1R (0.48) | MEN1KMT2AMAPTALDH1A1KDM4E | |
| SCHEMBL175118 | 0.80 | RAB9A (0.58) | MEN1KMT2AMAPTHTTALDH1A1 | |
| SCHEMBL27807412 | 0.78 | MAPT (0.51) | MEN1KMT2AMAPTHTTALDH1A1 | |
| SCHEMBL175262 | 0.77 | SMN1; SMN2 (0.55) | MEN1KMT2AMAPTKDM4ESMN1; SMN2 | |
| Trifluoroacetic Acid SCHEMBL165260 | 0.76 | IGF1R (0.44) | MEN1KMT2AMAPTALDH1A1KDM4E | |
| SCHEMBL174238 | 0.74 | DDX3X (0.52) | MEN1KMT2AMAPTHTTALDH1A1 | |
| SCHEMBL4569778 | 0.73 | MEN1 (0.53) | MEN1KMT2AMAPTHTTALDH1A1 |
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-2611806-A1 | DEUTERIUM-ENRICHED HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS | Ascepion Pharmaceuticals, Inc. (CN) | 2013-07-10 | — | — | EP | disclosed |
| WO-2012028106-A1 | DEUTERIUM-ENRICHED HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS | ASCEPION PHARMACEUTICALS, INC. (CN) | 2012-03-08 | — | — | WO | disclosed |