Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.43 |
| ▸ | RAB9A | P51151 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.42 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.40 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.40 |
| ▸ | CASR | P41180 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3677914 | 0.70 | CHRM2 (0.44) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL10548809 | 0.70 | CRBN (0.44) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL3673583 | 0.69 | CASR (0.46) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL14940197 | 0.68 | NPC1 (0.45) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL3680339 | 0.68 | ALDH1A1 (0.43) | NPC1RAB9AMAPTCHRM2CHRM4 | |
| SCHEMBL14939256 | 0.67 | HSP90AA1 (0.42) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL29895673 | 0.67 | CHRM2 (0.43) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL22171182 | 0.67 | CHRM2 (0.43) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL4908372 | 0.67 | CASR (0.50) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL13508831 | 0.67 | ALDH1A1 (0.42) | NPC1RAB9AMEN1KMT2AMAPT |
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-2013068785-A1 | INDANONE AND INDANDIONE DERIVATIVES AND HETEROCYCLIC ANALOGS | ACTELION PHARMACEUTICALS LTD (CH) | 2013-05-16 | — | — | WO | disclosed |