Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.65 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.65 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.63 |
| ▸ | POLB | P06746 | 3/20 | 0.63 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.63 |
| ▸ | THRB | P10828 | 1/20 | 0.63 |
| ▸ | BLM | P54132 | 1/20 | 0.63 |
| ▸ | ATM | Q13315 | 1/20 | 0.63 |
| ▸ | HTT | P42858 | 3/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.53 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.53 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.53 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.52 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.52 |
| ▸ | NAMPT | P43490 | 1/20 | 0.51 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.48 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL5508324 | 0.85 | ALDH1A1 (0.70) | ALDH1A1NFKB1KCNH2SMN1; SMN2POLB | |
| SCHEMBL12368426 | 0.85 | ALDH1A1 (0.65) | ALDH1A1NFKB1KCNH2SMN1; SMN2POLB | |
| SCHEMBL19013029 | 0.84 | MEN1 (0.63) | ALDH1A1SMN1; SMN2THRBHTTTP53 | |
| SCHEMBL5502874 | 0.83 | SMN1; SMN2 (0.79) | ALDH1A1NFKB1KCNH2SMN1; SMN2POLB | |
| SCHEMBL22458558 | 0.82 | SMN1; SMN2 (0.60) | ALDH1A1NFKB1KCNH2SMN1; SMN2POLB | |
| SCHEMBL5506823 | 0.81 | SMN1; SMN2 (0.77) | ALDH1A1NFKB1KCNH2SMN1; SMN2POLB | |
| SCHEMBL10755434 | 0.81 | SMN1; SMN2 (0.63) | ALDH1A1NFKB1KCNH2SMN1; SMN2POLB | |
| SCHEMBL11196763 | 0.81 | ALDH1A1 (0.64) | ALDH1A1NFKB1KCNH2SMN1; SMN2POLB | |
| SCHEMBL13015281 | 0.80 | CD274 (0.56) | ALDH1A1NFKB1KCNH2SMN1; SMN2POLB | |
| SCHEMBL10872851 | 0.80 | LMNA (0.69) | ALDH1A1SMN1; SMN2POLBCYP3A4HTT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0734526-A4 | MALEIMIDE ADDUCT CONJUGATES OF PROCAINAMIDE AND NAPA | ROCHE DIAGNOSTICS CORP (US) | 2000-03-29 | — | — | EP | disclosed |
| EP-0734526-A1 | MALEIMIDE ADDUCT CONJUGATES OF PROCAINAMIDE AND NAPA | BOEHRINGER MANNHEIM CORPORATION (US) | 1996-10-02 | — | — | EP | disclosed |
| US-5439798-A | Immunoassay; competitive binding; quantitative analysis | BOEHRINGER MANNHEIM CORPORATION (US) | 1995-08-08 | — | — | US | disclosed |
| WO-1995016894-A1 | MALEIMIDE ADDUCT CONJUGATES OF PROCAINAMIDE AND NAPA | BOEHRINGER MANNHEIM CORPORATION (US) | 1995-06-22 | — | — | WO | disclosed |