Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | MGAM | O43451 | 1/20 | 0.35 |
| ▸ | SI | P14410 | 1/20 | 0.35 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | CTSS | P25774 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL583466 | 0.92 | POLB (0.43) | MAPK1CYP3A4CYP2C19SMN1; SMN2TP53 | |
| SCHEMBL584297 | 0.84 | CYP2C19 (0.38) | MAPK1CYP3A4CYP2C19SMN1; SMN2TP53 | |
| SCHEMBL584691 | 0.84 | GAA (0.39) | MAPK1CYP3A4CYP2C19SMN1; SMN2TP53 | |
| SCHEMBL434421 | 0.82 | MGAM (0.52) | SMN1; SMN2TSHRPOLBALDH1A1GAA | |
| SCHEMBL1617817 | 0.80 | GAA (0.54) | SMN1; SMN2TSHRPOLBALDH1A1GAA | |
| SCHEMBL21987643 | 0.79 | ALDH1A1 (0.40) | MAPK1CYP2C19SMN1; SMN2TSHRPOLB | |
| SCHEMBL2005270 | 0.77 | GAA (0.54) | SMN1; SMN2TSHRALDH1A1GAAMGAM | |
| SCHEMBL5618 | 0.74 | CYP3A4 (0.49) | MAPK1CYP3A4CYP2C19SMN1; SMN2TP53 | |
| SCHEMBL1014646 | 0.73 | GAA (0.58) | ALDH1A1GAAMGAMSIMGAM2 | |
| SCHEMBL771683 | 0.73 | GAA (0.48) | TSHRPOLBALDH1A1GAAMGAM |
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-2417138-A1 | PYRAZOLO [1, 5-A] PYRIMIDINE DERIVATIVES AS MTOR INHIBITORS | Schering Corporation (US) | 2012-02-15 | — | — | EP | disclosed |
| WO-2010118207-A1 | PYRAZOLO [1, 5-A] PYRIMIDINE DERIVATIVES AS MTOR INHIBITORS | SCHERING CORPORATION (US) | 2010-10-14 | — | — | WO | disclosed |