Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | MGAM | O43451 | 1/20 | 0.38 |
| ▸ | SI | P14410 | 1/20 | 0.38 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 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 | |
|---|---|---|---|---|
| SCHEMBL93928 | 0.79 | GAA (0.41) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL27963209 | 0.78 | GAA (0.39) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL8755750 | 0.78 | GAA (0.39) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL1070746 | 0.76 | GAA (0.46) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL11183763 | 0.76 | GAA (0.38) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL11228277 | 0.76 | ALDH1A1 (0.36) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL7713280 | 0.75 | GAA (0.55) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL9863845 | 0.74 | TSHR (0.41) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL10943550 | 0.74 | — | — | |
| SCHEMBL6993745 | 0.73 | MAPT (0.43) | GAAMGAMSIMGAM2ALDH1A1 |
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-2021018047-A1 | PYRIDINE DERIVATIVE AS FGFR AND VEGFR DUAL INHIBITORS | 南京明德新药研发有限公司 | 2021-02-04 | — | — | WO | disclosed |