Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | LTB4R2 | Q9NPC1 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL28349380 | 0.76 | ALDH1A1 (0.46) | SMN1; SMN2TP53ALDH1A1GLATSHR | |
| SCHEMBL9756803 | 0.75 | ALDH1A1 (0.47) | SMN1; SMN2TP53ALDH1A1GLATSHR | |
| SCHEMBL9756801 | 0.75 | ALDH1A1 (0.47) | SMN1; SMN2TP53ALDH1A1GLATSHR | |
| SCHEMBL11404737 | 0.72 | ALDH1A1 (0.52) | SMN1; SMN2TP53ALDH1A1GLATSHR | |
| SCHEMBL1172092 | 0.72 | TLR2 (0.44) | SMN1; SMN2ALDH1A1TSHRMEN1KMT2A | |
| SCHEMBL1532583 | 0.72 | TLR2 (0.44) | SMN1; SMN2ALDH1A1TSHRMEN1KMT2A | |
| SCHEMBL9756867 | 0.72 | MAPT (0.52) | ALDH1A1TSHRMEN1KMT2AMAPT | |
| SCHEMBL12088220 | 0.70 | SMN1; SMN2 (0.45) | SMN1; SMN2TP53ALDH1A1MEN1KMT2A | |
| SCHEMBL3650058 | 0.70 | ALDH1A1 (0.46) | SMN1; SMN2TP53ALDH1A1GLATSHR | |
| Acetic Acid SCHEMBL28235752 | 0.70 | TLR2 (0.43) | SMN1; SMN2ALDH1A1TSHRMEN1KMT2A |
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-0316374-B1 | OPTICALLY ACTIVE COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 1991-07-31 | — | — | EP | disclosed |