Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CRHBP | P24387 | 1/20 | 0.35 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.35 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.33 |
| ▸ | IGF1R | P08069 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ATF1 | P18846 | 2/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.32 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.31 |
| ▸ | SMARCA2 | P51531 | 1/20 | 0.31 |
| ▸ | SMARCA4 | P51532 | 1/20 | 0.31 |
| ▸ | SDHB | P21912 | 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 | |
|---|---|---|---|---|
| SCHEMBL21381568 | 0.80 | MAPK1 (0.44) | MAPK1CYP2C19CYP3A4CYP2D6TSHR | |
| SCHEMBL21392136 | 0.77 | LMNA (0.45) | MAPK1CYP2C19CYP3A4CYP2D6TSHR | |
| SCHEMBL22767093 | 0.70 | CYP2C19 (0.61) | CYP2C19CYP3A4CYP2D6TSHRCRHBP | |
| SCHEMBL16095194 | 0.70 | MAPT (0.46) | MAPTALDH1A1HPGDMRGPRX4SDHB | |
| SCHEMBL22924876 | 0.69 | IGF1R (0.36) | MAPK1IGF1RMAPTALDH1A1HPGD | |
| SCHEMBL5998172 | 0.68 | PTGS1 (0.39) | MAPK1CYP2C19CYP3A4CYP2D6TSHR | |
| SCHEMBL21392139 | 0.67 | KDM4E (0.47) | MAPTMEN1ALDH1A1HPGDKMT2A | |
| SCHEMBL30261798 | 0.66 | KMO (0.45) | TSHRIGF1RMAPTMEN1HPGD | |
| SCHEMBL25859898 | 0.66 | KMO (0.45) | TSHRIGF1RMAPTMEN1HPGD | |
| SCHEMBL6468496 | 0.65 | NT5E (0.42) | CYP2C19CYP3A4CYP2D6TSHRCRHBP |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019179652-A1 | AMINOPYRIMIDINE DERIVATIVES AS CTPS1 INHIBITORS | STEP PHARMA S.A.S. (FR) | 2019-09-26 | — | — | WO | disclosed |