Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | RHEB | Q15382 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.40 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4900723 | 0.85 | ALDH1A1 (0.53) | RHEBKDM4EALDH1A1MAPTMEN1 | |
| SCHEMBL7964670 | 0.85 | ALDH1A1 (0.53) | RHEBKDM4EALDH1A1MAPTMEN1 | |
| SCHEMBL4900717 | 0.85 | ALDH1A1 (0.53) | RHEBKDM4EALDH1A1MAPTMEN1 | |
| SCHEMBL20655546 | 0.85 | KDM4E (0.44) | BRD4KDM4EALDH1A1MAPTMEN1 | |
| SCHEMBL13354918 | 0.76 | ALDH1A1 (0.48) | BRD4KDM4EALDH1A1MAPTMEN1 | |
| SCHEMBL13354926 | 0.76 | ALDH1A1 (0.48) | BRD4KDM4EALDH1A1MAPTMEN1 | |
| SCHEMBL13355032 | 0.76 | ALDH1A1 (0.48) | BRD4KDM4EALDH1A1MAPTMEN1 | |
| SCHEMBL1710088 | 0.74 | ALDH1A1 (0.68) | BRD4KDM4EALDH1A1MAPTMEN1 | |
| SCHEMBL9450134 | 0.73 | ALDH1A1 (0.48) | RHEBKDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL16519633 | 0.73 | ALDH1A1 (0.44) | BRD4KDM4EALDH1A1MAPTMEN1 |
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-2017114500-A1 | ACRYLANILIDE DERIVATIVE, PREPARATION METHOD THEREFOR, AND APPLICATIONS THEREOF IN PHARMACY | 恩瑞生物医药科技（上海）有限公司 | 2017-07-06 | — | — | WO | disclosed |