Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | MPO | P05164 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | GPR6 | P46095 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14939504 | 0.94 | ALDH1A1 (0.35) | BCHEACHEALDH1A1KDM4EHTT | |
| SCHEMBL14939715 | 0.94 | BCHE (0.36) | BCHEACHEALDH1A1KDM4EKMT2A | |
| SCHEMBL14939545 | 0.92 | ALDH1A1 (0.36) | BCHEACHEALDH1A1KDM4EKMT2A | |
| SCHEMBL14939156 | 0.92 | BCHE (0.35) | BCHEACHEALDH1A1KDM4EKMT2A | |
| SCHEMBL14940019 | 0.91 | NPSR1 (0.40) | ALDH1A1KDM4EKMT2AMEN1NPSR1 | |
| SCHEMBL14939157 | 0.89 | HTR7 (0.39) | ALDH1A1KDM4EKMT2AMEN1MAPK1 | |
| SCHEMBL14938818 | 0.88 | ALDH1A1 (0.38) | BCHEACHEALDH1A1KDM4EKMT2A | |
| SCHEMBL14939712 | 0.88 | BCHE (0.36) | BCHEACHEALDH1A1KDM4EKMT2A | |
| SCHEMBL14939319 | 0.88 | ALDH1A1 (0.40) | ACHEALDH1A1KDM4EKMT2AMEN1 | |
| SCHEMBL14939125 | 0.88 | ALDH1A1 (0.40) | ACHEALDH1A1KDM4EKMT2AMEN1 |
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 |