Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | KCNN4 | O15554 | 5/20 | 0.42 |
| ▸ | KIF11 | P52732 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Phenylethylmalonamide SCHEMBL341785 | 0.92 | MAPT (0.55) | KMT2AMAPTHTTCYP1A2CYP2D6 | |
| Phenylethylmalonamide SCHEMBL29755357 | 0.90 | MAPT (0.53) | KMT2AMAPTHTTCYP1A2CYP2D6 | |
| SCHEMBL2291949 | 0.88 | CYP2C19 (0.47) | KMT2AMAPTHTTCYP1A2CYP2D6 | |
| SCHEMBL21269982 | 0.86 | CYP2C19 (0.45) | KMT2AMAPTHTTCYP1A2CYP2D6 | |
| SCHEMBL21269854 | 0.86 | CYP2C19 (0.45) | KMT2AMAPTHTTCYP1A2CYP2D6 | |
| SCHEMBL28316424 | 0.86 | CYP2C19 (0.45) | KMT2AMAPTHTTCYP1A2CYP2D6 | |
| SCHEMBL28875698 | 0.86 | CYP2C19 (0.45) | KMT2AMAPTHTTCYP1A2CYP2D6 | |
| SCHEMBL21268799 | 0.86 | CYP2C19 (0.45) | KMT2AMAPTHTTCYP1A2CYP2D6 | |
| SCHEMBL28314575 | 0.86 | CYP2C19 (0.45) | KMT2AMAPTHTTCYP1A2CYP2D6 | |
| SCHEMBL28314612 | 0.84 | CYP2C19 (0.44) | KMT2AMAPTHTTCYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105229166-B | Carry out the method and kit of in situ hybridization | 塞雷公司 | 2018-04-27 | — | — | CN | disclosed |
| EP-1091958-A1 | SALTS OF PAROXETINE | SMITHKLINE BEECHAM PLC (GB) | 2001-04-18 | — | — | EP | disclosed |
| WO-2000001692-A1 | SALTS OF PAROXETINE | SMITHKLINE BEECHAM PLC (GB) | 2000-01-13 | — | — | WO | disclosed |