Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | MPO | P05164 | 1/20 | 0.35 |
| ▸ | HTR6 | P50406 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 2/20 | 0.32 |
| ▸ | DRD4 | P21917 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14939513 | 0.93 | ALDH1A1 (0.36) | MPOHTR6ALDH1A1MAPTKDM4E | |
| SCHEMBL14939853 | 0.92 | ALDH1A1 (0.36) | BCHEACHEMPOHTR6ALDH1A1 | |
| SCHEMBL14939949 | 0.88 | TP53 (0.41) | HTR6ALDH1A1MAPTTP53KDM4E | |
| SCHEMBL14939286 | 0.88 | BCHE (0.35) | BCHEACHEMPOHTR6ALDH1A1 | |
| SCHEMBL14939526 | 0.88 | NPSR1 (0.46) | ALDH1A1MAPTKDM4EHTTMEN1 | |
| SCHEMBL14940045 | 0.85 | HTR6 (0.38) | MPOHTR6ALDH1A1KDM4EGAA | |
| SCHEMBL14939854 | 0.84 | CHRM2 (0.43) | ACHEALDH1A1KDM4EHTTDRD2 | |
| SCHEMBL14938855 | 0.83 | ALDH1A1 (0.38) | MPOHTR6ALDH1A1MAPTTP53 | |
| SCHEMBL14940190 | 0.83 | ALDH1A1 (0.37) | MPOHTR6ALDH1A1MAPTKDM4E | |
| SCHEMBL14940207 | 0.82 | ALDH1A1 (0.46) | ACHEHTR6ALDH1A1KDM4EGAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013068785-A1 | INDANONE AND INDANDIONE DERIVATIVES AND HETEROCYCLIC ANALOGS | ACTELION PHARMACEUTICALS LTD (CH) | 2013-05-16 | — | — | WO | claimed |
| WO-2013068785-A1 | INDANONE AND INDANDIONE DERIVATIVES AND HETEROCYCLIC ANALOGS | ACTELION PHARMACEUTICALS LTD (CH) | 2013-05-16 | — | — | WO | disclosed |