Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 2/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL2572768 | 0.78 | CA12 (0.37) | ALDH1A1MAPTTSHRCYP2C9NPSR1 | |
| SCHEMBL3004759 | 0.78 | CYP1A2 (0.30) | — | |
| SCHEMBL2572352 | 0.76 | ALDH1A1 (0.38) | ALDH1A1MAPTTSHRCYP2C9NPSR1 | |
| SCHEMBL11901718 | 0.71 | CYP2C9 (0.38) | ALDH1A1TSHRCYP2C9NPSR1KDM4E | |
| SCHEMBL11901721 | 0.71 | CYP2C9 (0.38) | ALDH1A1TSHRCYP2C9NPSR1KDM4E | |
| SCHEMBL13911904 | 0.71 | CYP2C9 (0.38) | ALDH1A1TSHRCYP2C9NPSR1KDM4E | |
| SCHEMBL655921 | 0.67 | RAB9A (0.44) | ALDH1A1MAPTRAB9AGAAPOLB | |
| SCHEMBL837941 | 0.66 | MGAM (0.42) | ALDH1A1MAPTCYP2C9NPSR1SMN1; SMN2 | |
| SCHEMBL12682934 | 0.65 | CA12 (0.38) | ALDH1A1CYP2C9NPSR1SMN1; SMN2L3MBTL1 | |
| SCHEMBL2825743 | 0.65 | MEN1 (0.39) | ALDH1A1MAPTTSHRRAB9APOLB |
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-2382218-A1 | DELTA-5-DESATURASE INHIBITORS | Takeda Pharmaceutical Company Limited (JP) | 2011-11-02 | — | — | EP | disclosed |