Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.39 |
| ▸ | CDK1 | P06493 | 1/20 | 0.39 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.39 |
| ▸ | GSK3A | P49840 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.39 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.39 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.39 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.39 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.38 |
| ▸ | MAPK13 | O15264 | 2/20 | 0.38 |
| ▸ | MAPK12 | P53778 | 2/20 | 0.38 |
| ▸ | MAPK11 | Q15759 | 2/20 | 0.38 |
| ▸ | SMPD3 | Q9NY59 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17604614 | 0.86 | MAPK14 (0.46) | MAPK14GSK3BMAPK13MAPK12MAPK11 | |
| SCHEMBL16094913 | 0.85 | MAPK14 (0.39) | MAPK14KDM4EGSK3BMAPK13MAPK12 | |
| SCHEMBL28524044 | 0.79 | MEN1 (0.54) | KMT2AMEN1KDM4EDYRK1ACLK4 | |
| SCHEMBL16095454 | 0.79 | MAPK14 (0.41) | MAPK14GSK3BMAPK13MAPK12MAPK11 | |
| SCHEMBL16095792 | 0.78 | KDM4C (0.58) | KMT2AMEN1KDM4EALDH1A1GAA | |
| SCHEMBL16095120 | 0.78 | KDM4C (0.41) | MAPK14GSK3B | |
| SCHEMBL9749306 | 0.75 | HPGD (0.62) | KMT2AMEN1MAPK14KDM4ECCNB2 | |
| SCHEMBL17604545 | 0.75 | NPY5R (0.37) | — | |
| SCHEMBL16094945 | 0.74 | KDM4C (0.51) | MAPK14MAPK13MAPK12MAPK11 | |
| SCHEMBL16095479 | 0.74 | KDM4C (0.65) | MAPK14GAA |
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-2969007-A1 | HISTONE DEMETHYLASE INHIBITORS | Quanticel Pharmaceuticals Inc (US) | 2016-01-20 | — | — | EP | disclosed |
| WO-2014151945-A1 | HISTONE DEMETHYLASE INHIBITORS | Quanticel Pharmaceuticals, Inc. (US) | 2014-09-25 | — | — | WO | disclosed |