Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL543641 | 1.00 | GAA (0.39) | GAATBXAS1MAPK1KDM4ENPSR1 | |
| SCHEMBL543322 | 0.83 | EPHX2 (0.36) | GAATBXAS1ALDH1A1TGFBR1 | |
| SCHEMBL543323 | 0.83 | EPHX2 (0.36) | GAATBXAS1ALDH1A1TGFBR1 | |
| SCHEMBL543912 | 0.76 | EGLN2 (0.39) | GAATBXAS1HSD17B10ALDH1A1MAPT | |
| SCHEMBL543913 | 0.76 | EGLN2 (0.39) | GAATBXAS1HSD17B10ALDH1A1MAPT | |
| SCHEMBL2779593 | 0.75 | TBXAS1 (0.41) | GAATBXAS1MAPK1KDM4ENPSR1 | |
| SCHEMBL2779586 | 0.75 | TBXAS1 (0.41) | GAATBXAS1MAPK1KDM4ENPSR1 | |
| SCHEMBL543639 | 0.73 | GAA (0.46) | GAAMAPK1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL10257281 | 0.73 | GAA (0.46) | GAAMAPK1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL15768871 | 0.69 | HDAC1 (0.44) | GAATBXAS1MAPK1KDM4ENPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8110585-B2 | Bicyclic compound and pharmaceutical use thereof | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-02-07 | — | — | US | disclosed |