Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | RARB | P10826 | 7/20 | 0.46 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.46 |
| ▸ | RXRA | P19793 | 2/20 | 0.44 |
| ▸ | RXRB | P28702 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | RARA | P10276 | 1/20 | 0.44 |
| ▸ | MTOR | P42345 | 1/20 | 0.44 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.43 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.43 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.43 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.42 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.42 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.41 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9260592 | 0.86 | MAPT (0.59) | MAPK1ALDH1A1RARBRXRARXRB | |
| SCHEMBL9259790 | 0.86 | MAPT (0.59) | MAPK1ALDH1A1RARBRXRARXRB | |
| SCHEMBL14966914 | 0.84 | CYP4A11 (0.55) | ALDH1A1MAPTCYP4F2CYP4A11 | |
| Bicarbonate SCHEMBL28004675 | 0.83 | TDP1 (0.46) | ALDH1A1KMT2A | |
| SCHEMBL1750698 | 0.83 | ALDH1A1 (0.56) | MAPK1ALDH1A1NR1H4RXRARXRB | |
| SCHEMBL986621 | 0.81 | ALDH1A1 (0.57) | ALDH1A1RARBRXRARXRBMAPT | |
| SCHEMBL3656274 | 0.79 | RARB (0.57) | ALDH1A1RARBRXRARXRBMAPT | |
| SCHEMBL985544 | 0.79 | KMT2A (0.50) | MAPK1ALDH1A1RARBRXRARXRB | |
| SCHEMBL31651134 | 0.79 | ESR1 (0.48) | ALDH1A1MAPTKMT2A | |
| SCHEMBL15899454 | 0.79 | ACACB (0.44) | ALDH1A1KMT2AMEN1 |
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-2780013-A1 | MODULATORS OF METHYL MODIFYING ENZYMES, COMPOSITIONS AND USES THEREOF | Constellation Pharmaceuticals, Inc. (US) | 2014-09-24 | — | — | EP | disclosed |
| WO-2013075084-A1 | MODULATORS OF METHYL MODIFYING ENZYMES, COMPOSITIONS AND USES THEREOF | CONSTELLATION PHARMACEUTICALS (US) | 2013-05-23 | — | — | WO | disclosed |