Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | PLAU | P00749 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CFTR | P13569 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.35 |
| ▸ | FEN1 | P39748 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | AGBL2 | Q5U5Z8 | 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 | |
|---|---|---|---|---|
| SCHEMBL31504482 | 1.00 | ALDH1A1 (0.51) | ALDH1A1NPSR1PLAUKDM4EKMT2A | |
| SCHEMBL31202649 | 0.77 | ALDH1A1 (0.45) | ALDH1A1NPSR1PLAUKDM4EKMT2A | |
| SCHEMBL17027113 | 0.77 | ALDH1A1 (0.45) | ALDH1A1NPSR1PLAUKDM4EKMT2A | |
| SCHEMBL16360536 | 0.75 | LMNA (0.33) | LMNA | |
| SCHEMBL28641181 | 0.72 | ALDH1A1 (0.47) | ALDH1A1NPSR1PLAUKDM4EKMT2A | |
| SCHEMBL18735816 | 0.72 | NOS1 (0.42) | PLAUKDM4E | |
| SCHEMBL31628187 | 0.72 | NOS1 (0.42) | PLAUKDM4E | |
| SCHEMBL23746896 | 0.69 | ALDH1A1 (0.45) | ALDH1A1NPSR1PLAUKDM4EKMT2A | |
| SCHEMBL30060619 | 0.69 | ALDH1A1 (0.45) | ALDH1A1NPSR1PLAUKDM4EKMT2A | |
| SCHEMBL20354681 | 0.69 | ALDH1A1 (0.49) | ALDH1A1NPSR1PLAUKDM4EKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-106231905-A | Diaryl azole compounds | 住友化学株式会社 | 2016-12-14 | — | — | CN | disclosed |