Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.64 |
| ▸ | GAA | P10253 | 2/20 | 0.64 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | CA7 | P43166 | 2/20 | 0.34 |
| ▸ | CA9 | Q16790 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL19850673 | 0.92 | GAA (0.57) | SMN1; SMN2GAAPOLBKDM4EMAPT | |
| SCHEMBL9786463 | 0.92 | GAA (0.57) | SMN1; SMN2GAAPOLBKDM4EMAPT | |
| SCHEMBL1169368 | 0.81 | SMN1; SMN2 (0.56) | SMN1; SMN2GAAPOLBKDM4EMAPT | |
| SCHEMBL9803175 | 0.76 | SMN1; SMN2 (0.53) | SMN1; SMN2GAAPOLBKDM4EMAPT | |
| SCHEMBL14895396 | 0.76 | SMN1; SMN2 (0.53) | SMN1; SMN2GAAPOLBKDM4EMAPT | |
| SCHEMBL3904169 | 0.74 | SMN1; SMN2 (0.90) | SMN1; SMN2GAAMAPTMEN1KMT2A | |
| SCHEMBL19850686 | 0.73 | GAA (0.47) | SMN1; SMN2GAAPOLBKDM4EMAPT | |
| SCHEMBL16032593 | 0.72 | SMN1; SMN2 (0.50) | SMN1; SMN2GAAPOLBLMNAALDH1A1 | |
| SCHEMBL21108205 | 0.72 | GAA (0.46) | SMN1; SMN2GAAPOLBKDM4EMAPT | |
| SCHEMBL9802440 | 0.71 | GAA (0.71) | SMN1; SMN2GAAPOLBMAPTMEN1 |
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-2018026798-A1 | SPIRO-LACTAM NMDA MODULATORS AND METHODS OF USING SAME | APTINYX INC. (US) | 2018-02-08 | — | — | WO | disclosed |