Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | DPP4 | P27487 | 2/20 | 0.33 |
| ▸ | DPP8 | Q6V1X1 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ALPL | P05186 | 1/20 | 0.32 |
| ▸ | ALPI | P09923 | 1/20 | 0.32 |
| ▸ | ALPG | P10696 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | KCNK3 | O14649 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2276782 | 0.87 | NPC1 (0.41) | NPC1GAAL3MBTL1TDP1DPP4 | |
| SCHEMBL2227259 | 0.82 | GAA (0.55) | GAAL3MBTL1SMN1; SMN2HPGDALDH1A1 | |
| SCHEMBL2228196 | 0.73 | NPC1 (0.43) | NPC1GAAL3MBTL1TDP1DPP4 | |
| Hydrochloric Acid SCHEMBL10447048 | 0.72 | GRM7 (0.45) | NPC1GAAL3MBTL1TDP1HPGD | |
| SCHEMBL2227333 | 0.71 | NPC1 (0.41) | NPC1GAAL3MBTL1TDP1DPP4 | |
| SCHEMBL28282916 | 0.70 | NPC1 (0.41) | NPC1GAAL3MBTL1TDP1HPGD | |
| SCHEMBL2228026 | 0.69 | GAA (0.56) | GAAL3MBTL1HPGDALDH1A1KDM4E | |
| SCHEMBL3447974 | 0.66 | MIF (0.43) | NPC1TDP1HPGDALDH1A1KDM4E | |
| SCHEMBL2847032 | 0.64 | LMNA (0.52) | NPC1TDP1HPGDALDH1A1KDM4E | |
| SCHEMBL8916220 | 0.64 | TDP1 (0.46) | NPC1GAAL3MBTL1TDP1HPGD |
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-2011091346-A2 | POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS CONTAINING A PROTECTED AMINO GROUP | BRIDGESTONE CORPORATION (JP) | 2011-07-28 | — | — | WO | disclosed |