Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | KLKB1 | P03952 | 2/20 | 0.38 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | MMP13 | P45452 | 3/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
| ▸ | STAT3 | P40763 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | MMP10 | P09238 | 1/20 | 0.36 |
| ▸ | MMP8 | P22894 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14967153 | 0.88 | KDM4E (0.40) | LMNASMN1; SMN2KLKB1MAP4K1NPC1 | |
| SCHEMBL14967113 | 0.87 | LMNA (0.50) | LMNASMN1; SMN2NPC1RAB9ARECQL | |
| SCHEMBL14966459 | 0.84 | KLKB1 (0.40) | LMNASMN1; SMN2KLKB1MAP4K1RECQL | |
| SCHEMBL14966830 | 0.84 | KLKB1 (0.44) | SMN1; SMN2KLKB1MAP4K1RECQL | |
| SCHEMBL14966778 | 0.82 | NPC1 (0.49) | LMNASMN1; SMN2NPC1CYP3A4MMP13 | |
| SCHEMBL14966659 | 0.82 | LMNA (0.48) | LMNASMN1; SMN2KLKB1NPC1RAB9A | |
| SCHEMBL14967108 | 0.82 | ROCK2 (0.37) | LMNASMN1; SMN2KLKB1MAP4K1CYP3A4 | |
| SCHEMBL14966647 | 0.82 | SCN9A (0.44) | LMNASMN1; SMN2RAB9ACYP3A4MMP13 | |
| SCHEMBL14966474 | 0.82 | MAPK14 (0.44) | LMNASMN1; SMN2NPC1RAB9AMAPK14 | |
| SCHEMBL14966453 | 0.81 | NR1H4 (0.39) | LMNASMN1; SMN2KLKB1MAP4K1NPC1 |
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-2780014-A1 | MODULATORS OF METHYL MODIFYING ENZYMES, COMPOSITIONS AND USES THEREOF | Constellation Pharmaceuticals, Inc. (US) | 2014-09-24 | — | — | EP | disclosed |
| WO-2013075083-A1 | MODULATORS OF METHYL MODIFYING ENZYMES, COMPOSITIONS AND USES THEREOF | CONSTELLATION PHARMACEUTICALS (US) | 2013-05-23 | — | — | WO | disclosed |