Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.67 |
| ▸ | TSHR | P16473 | 6/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.67 |
| ▸ | LMNA | P02545 | 3/20 | 0.67 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.67 |
| ▸ | MAPT | P10636 | 3/20 | 0.65 |
| ▸ | MEN1 | O00255 | 1/20 | 0.65 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.65 |
| ▸ | PLD3 | Q8IV08 | 1/20 | 0.64 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.63 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.63 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.63 |
| ▸ | HTT | P42858 | 2/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | GFER | P55789 | 1/20 | 0.57 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL29256877 | 0.89 | THRB (0.61) | ALDH1A1TSHRSMN1; SMN2LMNANPSR1 | |
| SCHEMBL29256882 | 0.86 | MAOB (0.57) | ALDH1A1TSHRSMN1; SMN2LMNANPSR1 | |
| SCHEMBL7017271 | 0.83 | TSHR (0.59) | ALDH1A1TSHRSMN1; SMN2LMNANPSR1 | |
| SCHEMBL17772710 | 0.82 | ALDH1A1 (0.76) | ALDH1A1TSHRSMN1; SMN2LMNANPSR1 | |
| SCHEMBL19560437 | 0.80 | SMN1; SMN2 (0.55) | ALDH1A1TSHRSMN1; SMN2LMNANPSR1 | |
| SCHEMBL16029641 | 0.80 | TSHR (0.70) | ALDH1A1TSHRSMN1; SMN2LMNAMAPT | |
| SCHEMBL13938943 | 0.80 | ALDH1A1 (0.62) | ALDH1A1TSHRSMN1; SMN2LMNANPSR1 | |
| SCHEMBL5643509 | 0.80 | DPP4 (0.82) | ALDH1A1TSHRSMN1; SMN2LMNANPSR1 | |
| SCHEMBL18021083 | 0.78 | MAPT (0.58) | ALDH1A1TSHRSMN1; SMN2LMNANPSR1 | |
| SCHEMBL17772711 | 0.78 | MAPT (0.78) | ALDH1A1TSHRSMN1; SMN2LMNANPSR1 |
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-2014152287-A9 | SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF | HYDRA BIOSCIENCES, INC. (US) | 2015-04-23 | — | — | WO | disclosed |