Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 6/20 | 0.38 |
| ▸ | NPC1 | O15118 | 5/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2430364 | 0.89 | NPC1 (0.40) | NPSR1GAAKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL2433596 | 0.84 | MAPT (0.36) | GAAALDH1A1SMN1; SMN2HTTRAB9A | |
| SCHEMBL2431182 | 0.84 | ADORA2B (0.35) | GAAKDM4EALDH1A1SMN1; SMN2RAB9A | |
| SCHEMBL2433357 | 0.83 | GRM4 (0.32) | — | |
| SCHEMBL2432534 | 0.77 | MEN1 (0.45) | KDM4ESMN1; SMN2HTTRAB9ANPC1 | |
| SCHEMBL2432538 | 0.77 | MEN1 (0.45) | KDM4ESMN1; SMN2HTTRAB9ANPC1 | |
| SCHEMBL3807257 | 0.77 | KDM4E (0.39) | NPSR1GAAKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL2435755 | 0.76 | NPC1 (0.45) | GAAKDM4EALDH1A1RAB9ANPC1 | |
| SCHEMBL2435757 | 0.76 | NPC1 (0.45) | GAAKDM4EALDH1A1RAB9ANPC1 | |
| SCHEMBL2431500 | 0.74 | NPC1 (0.43) | KDM4EALDH1A1SMN1; SMN2RAB9ANPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2086966-B1 | 2-CARBOXY THIOPHENE DERIVATIVES AS ANTI VIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2011-09-14 | — | — | EP | claimed |