Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 13/20 | 0.67 |
| ▸ | KDM5A | P29375 | 1/20 | 0.48 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.48 |
| ▸ | DAO | P14920 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6613866 | 0.85 | SMN1; SMN2 (0.57) | GPR84KDM5AKDM5BDAO | |
| SCHEMBL14967358 | 0.84 | GPR84 (0.58) | GPR84 | |
| SCHEMBL6695551 | 0.79 | GPR84 (0.69) | GPR84DAOBACE1 | |
| SCHEMBL8885796 | 0.78 | MPO (0.51) | GPR84KDM5AKDM5B | |
| SCHEMBL11858938 | 0.78 | GPR84 (0.68) | GPR84DAOBACE1 | |
| SCHEMBL3676992 | 0.75 | GPR84 (0.55) | GPR84 | |
| SCHEMBL27766830 | 0.75 | GAA (0.59) | DAOGAA | |
| SCHEMBL14603936 | 0.75 | HCAR2 (0.54) | GPR84KDM5BDAO | |
| SCHEMBL3672125 | 0.74 | ALDH1A1 (0.37) | GPR84 | |
| SCHEMBL56627 | 0.74 | ALDH1A1 (0.44) | GPR84DAO |
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 |