Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | GFER | P55789 | 3/20 | 0.43 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.40 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ADK | P55263 | 3/20 | 0.38 |
| ▸ | AURKA | O14965 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | APP | P05067 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL24367756 | 0.91 | ALDH1A1 (0.50) | ALDH1A1KDM4EGFERSIRT2SIRT1 | |
| SCHEMBL25536931 | 0.86 | ALDH1A1 (0.45) | ALDH1A1KDM4EGFERSIRT2SIRT1 | |
| SCHEMBL21885770 | 0.84 | ALDH1A1 (0.45) | ALDH1A1KDM4EGFERSIRT2SIRT1 | |
| SCHEMBL13998682 | 0.79 | ALDH1A1 (0.52) | ALDH1A1KDM4ECYP2C19TSHRMAPT | |
| SCHEMBL21885768 | 0.78 | MAPT (0.46) | ALDH1A1KDM4EGFERCYP2C19TSHR | |
| SCHEMBL13916705 | 0.78 | ALDH1A1 (0.57) | ALDH1A1KDM4ECYP2C19TSHRMAPT | |
| SCHEMBL13916712 | 0.73 | ALDH1A1 (0.49) | ALDH1A1KDM4ECYP2C19TSHRHPGD | |
| SCHEMBL13053161 | 0.73 | ALDH1A1 (0.47) | ALDH1A1KDM4ECYP2C19TSHRMAPT | |
| SCHEMBL21290023 | 0.72 | ESR1 (0.42) | ALDH1A1CYP2C19TSHRMAPTLMNA | |
| SCHEMBL2602377 | 0.71 | AKT1 (0.43) | ALDH1A1KDM4ECYP2C19TSHRMAPT |
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-2020073011-A1 | COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH APJ RECEPTOR ACTIVITY | ANNAPURNA BIO, INC. (US) | 2020-04-09 | — | — | WO | disclosed |