Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 11/20 | 0.33 |
| ▸ | MAOB | P27338 | 6/20 | 0.33 |
| ▸ | MAOA | P21397 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.33 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.33 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | HTR1B | P28222 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | SCN1A | P35498 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.33 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.33 |
| ▸ | CCR2 | P41597 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4706897 | 0.80 | KCNN4 (0.38) | KDM1AMAOBLMNASLC6A4SLC6A2 | |
| SCHEMBL3346414 | 0.76 | LMNA (0.35) | LMNAMEN1CYP2D6HRH1SCN1A | |
| Hydrochloric Acid SCHEMBL11044496 | 0.74 | LMNA (0.38) | LMNAMEN1CYP2D6HRH1SCN1A | |
| SCHEMBL11006008 | 0.70 | CHRM3 (0.48) | GRIN2BSLC6A4SLC6A2HRH1 | |
| SCHEMBL11111197 | 0.69 | ALDH1A1 (0.41) | — | |
| Hydrochloric Acid SCHEMBL6529786 | 0.68 | BPTF (0.35) | LMNAMEN1CYP2D6HRH1SCN1A | |
| SCHEMBL31214046 | 0.67 | CYP2B6 (0.59) | GRIN2BLMNAHTR2AMEN1CYP2D6 | |
| SCHEMBL6025470 | 0.66 | CYP2B6 (0.34) | MEN1KMT2ACYP2B6 | |
| SCHEMBL4594663 | 0.66 | L3MBTL3 (0.45) | GRIN2BHTR2AMEN1CYP2D6HRH1 | |
| Hydrochloric Acid SCHEMBL8942152 | 0.64 | L3MBTL3 (0.44) | GRIN2BHTR2AMEN1CYP2D6HRH1 |
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-1945646-A1 | PYRIMIDINE COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS | Cellzome (UK) Ltd. (GB) | 2008-07-23 | — | — | EP | disclosed |
| WO-2007039467-A1 | PYRIMIDINE COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS | CELLZOME (UK) LTD. (GB) | 2007-04-12 | — | — | WO | disclosed |