Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APAF1 | O14727 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | HTT | P42858 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 5/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6920216 | 0.83 | APAF1 (0.50) | APAF1ALDH1A1HTTTP53ATM | |
| SCHEMBL1850785 | 0.79 | APAF1 (0.47) | APAF1ALDH1A1HTTTP53ATM | |
| SCHEMBL13177328 | 0.79 | APAF1 (0.50) | APAF1ALDH1A1HTTTP53ATM | |
| SCHEMBL2588908 | 0.78 | APAF1 (0.50) | APAF1ALDH1A1HTTTP53ATM | |
| SCHEMBL2591875 | 0.77 | APAF1 (0.57) | APAF1ALDH1A1HTTTP53ATM | |
| SCHEMBL15231004 | 0.75 | APAF1 (0.56) | APAF1ALDH1A1HTTTP53ATM | |
| SCHEMBL6417827 | 0.74 | ALDH1A1 (0.58) | APAF1ALDH1A1HTTTP53ATM | |
| Ethane SCHEMBL11828584 | 0.74 | ALDH1A1 (0.65) | APAF1ALDH1A1HTTTP53LMNA | |
| SCHEMBL9668224 | 0.73 | ALDH1A1 (0.35) | APAF1ALDH1A1GAA | |
| SCHEMBL8657294 | 0.73 | GLS (0.59) | ALDH1A1LMNANPSR1MAPTKDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0467707-A1 | Process for the preparation of 1-Hydroxymethylpyrazoles | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1992-01-22 | — | — | EP | claimed |
| EP-0467708-B1 | Control of microorganisms on plants with 1-hydroxymethylpyrazoles | BUCKMAN LABOR INC (US) | 1998-11-04 | — | — | EP | disclosed |
| EP-0467707-A1 | Process for the preparation of 1-Hydroxymethylpyrazoles | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1992-01-22 | — | — | EP | disclosed |