Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | TGM2 | P21980 | 6/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | F13A1 | P00488 | 3/20 | 0.44 |
| ▸ | TGM1 | P22735 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | SYK | P43405 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8497636 | 0.85 | ALDH1A1 (0.62) | ALDH1A1CYP3A4CYP2C9CYP2C19TGM2 | |
| SCHEMBL16283599 | 0.83 | ALDH1A1 (0.40) | ALDH1A1CYP3A4CYP2C9CYP2C19TGM2 | |
| SCHEMBL30780832 | 0.83 | ALDH1A1 (0.52) | ALDH1A1CYP3A4CYP2C9CYP2C19SMN1; SMN2 | |
| SCHEMBL8497091 | 0.82 | CTSS (0.52) | ALDH1A1CYP3A4CYP2C9CYP2C19TGM2 | |
| SCHEMBL26086092 | 0.80 | ALDH1A1 (0.49) | ALDH1A1CYP3A4CYP2C9CYP2C19TGM2 | |
| SCHEMBL2127059 | 0.79 | ALDH1A1 (0.55) | ALDH1A1KMT2AMEN1SMN1; SMN2HCAR2 | |
| SCHEMBL1728479 | 0.78 | SYK (0.53) | ALDH1A1KMT2AMEN1SMN1; SMN2SYK | |
| SCHEMBL12654689 | 0.77 | ALDH1A1 (0.53) | ALDH1A1KMT2AMEN1SMN1; SMN2HCAR2 | |
| SCHEMBL16370039 | 0.77 | ALDH1A1 (0.53) | ALDH1A1CYP3A4CYP2C9CYP2C19TGM2 | |
| SCHEMBL23766418 | 0.77 | ALDH1A1 (0.46) | ALDH1A1KMT2AMEN1SMN1; SMN2MAPK1 |
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-1147076-A1 | ACRYLAMIDE DERIVATIVES AND POLYMERS CONTAINING SAID DERIVATIVES | Amersham Pharmacia Biotech K.K. (JP) | 2001-10-24 | — | — | EP | disclosed |
| WO-2000043355-A1 | ACRYLAMIDE DERIVATIVES AND POLYMERS CONTAINING SAID DERIVATIVES | AMERSHAM PHARMACIA BIOTECH K.K. (JP) | 2000-07-27 | — | — | WO | disclosed |