Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | PTPRC | P08575 | 1/20 | 0.44 |
| ▸ | S100A4 | P26447 | 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 | |
|---|---|---|---|---|
| SCHEMBL8465035 | 0.80 | GPR35 (0.60) | GPR35ALDH1A1TP53HPGDTSHR | |
| SCHEMBL11028069 | 0.80 | GPR35 (0.69) | GPR35ALDH1A1TP53HPGDTSHR | |
| SCHEMBL6804413 | 0.79 | ALDH1A1 (0.53) | ALDH1A1TSHRCA1CA2CA7 | |
| SCHEMBL8382506 | 0.77 | POLB (0.64) | GPR35ALDH1A1TP53HPGDTSHR | |
| SCHEMBL6756941 | 0.75 | TDP1 (0.53) | ALDH1A1SMN1; SMN2MEN1KMT2ATDP1 | |
| SCHEMBL28607197 | 0.73 | GPR35 (0.51) | GPR35ALDH1A1TP53HPGDTSHR | |
| SCHEMBL5685580 | 0.73 | ALOX15 (0.46) | ALDH1A1TSHRMAPK1GAATHRB | |
| SCHEMBL28592473 | 0.73 | LMNA (0.55) | GPR35ALDH1A1TP53HPGDTSHR | |
| SCHEMBL8347590 | 0.73 | GPR35 (0.47) | GPR35ALDH1A1TP53HPGDTSHR | |
| SCHEMBL5684846 | 0.73 | CYP3A4 (0.44) | ALDH1A1TSHRMAPK1CA1CA2 |
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-1439175-B1 | PYRIMIDINE COMPOUND AND MEDICINAL COMPOSITION THEREOF | EISAI R&D MAN CO LTD (JP) | 2011-04-27 | — | — | EP | disclosed |