Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 6/20 | 0.41 |
| ▸ | KCNH3 | Q9ULD8 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | PDE5A | O76074 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | USP2 | O75604 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | NCF1 | P14598 | 2/20 | 0.39 |
| ▸ | HTR1B | P28222 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | GPR65 | Q8IYL9 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5745872 | 0.99 | KCNH3 (0.43) | MAPTKCNH3TP53PDE5AALOX15 | |
| SCHEMBL8382899 | 0.87 | HTR1B (0.43) | MAPTTP53ALOX15HSD17B10CYP1A2 | |
| SCHEMBL5747927 | 0.83 | TP53 (0.51) | MAPTTP53ALOX15HSD17B10ALDH1A1 | |
| SCHEMBL5749037 | 0.82 | HTR1B (0.57) | MAPTKCNH3PDE5AALOX15HSD17B10 | |
| Hydrochloric Acid SCHEMBL7076469 | 0.81 | PTGS2 (0.39) | MAPTTP53HTR1BHTR2BGPR65 | |
| SCHEMBL5750655 | 0.81 | HTR1B (0.44) | MAPTTP53ALOX15HSD17B10USP2 | |
| Fumaric Acid SCHEMBL7079401 | 0.79 | HTR1B (0.36) | MAPTTP53CYP1A2ALDH1A1CYP2D6 | |
| Fumaric Acid SCHEMBL7079403 | 0.79 | HTR1B (0.36) | MAPTTP53CYP1A2ALDH1A1CYP2D6 | |
| Bromide SCHEMBL5750479 | 0.77 | HTR1B (0.46) | MAPTKCNH3CYP1A2ALDH1A1HTT | |
| SCHEMBL5746700 | 0.73 | HTR1B (0.44) | MAPTTP53ALOX15HSD17B10USP2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0901474-B1 | ARYL PYRIMIDINE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2006-04-19 | — | — | EP | claimed |