Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.32 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.32 |
| ▸ | PPARD | Q03181 | 1/20 | 0.31 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.31 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.31 |
| ▸ | FAAH | O00519 | 1/20 | 0.30 |
| ▸ | CES1 | P23141 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1708611 | 0.85 | POLB (0.33) | ALDH1A1GAASMN1; SMN2TDP1L3MBTL1 | |
| SCHEMBL1708225 | 0.82 | KLKB1 (0.35) | ALDH1A1GAASMN1; SMN2TDP1L3MBTL1 | |
| SCHEMBL1708609 | 0.79 | FFAR1 (0.46) | PPARD | |
| SCHEMBL13047426 | 0.79 | FFAR1 (0.40) | PPARD | |
| SCHEMBL1707867 | 0.76 | ALDH1A1 (0.40) | ALDH1A1GAASMN1; SMN2TDP1L3MBTL1 | |
| SCHEMBL1707908 | 0.76 | CD274 (0.41) | PDCD1CD274 | |
| SCHEMBL1707923 | 0.75 | GAA (0.36) | ALDH1A1GAATDP1 | |
| SCHEMBL1708221 | 0.75 | INSR (0.34) | ALDH1A1GAASMN1; SMN2TDP1L3MBTL1 | |
| SCHEMBL1708599 | 0.75 | WNT3A (0.38) | — | |
| SCHEMBL1707989 | 0.75 | EED (0.38) | ALDH1A1GAASMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2440541-A1 | NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2012-04-18 | — | — | EP | disclosed |
| WO-2010143733-A1 | NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2010-12-16 | — | — | WO | disclosed |