Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | P2RX3 | P56373 | 4/20 | 0.40 |
| ▸ | CNR2 | P34972 | 13/20 | 0.39 |
| ▸ | CNR1 | P21554 | 8/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6189898 | 1.00 | NPC1 (0.43) | NPC1RAB9AATMALDH1A1HPGD | |
| SCHEMBL6190959 | 0.89 | NPSR1 (0.42) | NPC1RAB9AALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL6190964 | 0.89 | NPSR1 (0.42) | NPC1RAB9AALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL6192319 | 0.89 | CNR2 (0.38) | ALDH1A1HPGDNPSR1P2RX3CNR2 | |
| SCHEMBL6188288 | 0.89 | CNR2 (0.43) | P2RX3CNR2CNR1 | |
| SCHEMBL6192322 | 0.89 | CNR2 (0.38) | ALDH1A1HPGDNPSR1P2RX3CNR2 | |
| SCHEMBL6188291 | 0.89 | CNR2 (0.43) | P2RX3CNR2CNR1 | |
| SCHEMBL6190145 | 0.88 | ALDH1A1 (0.45) | ALDH1A1HPGDSMN1; SMN2NPSR1L3MBTL1 | |
| SCHEMBL6190142 | 0.88 | ALDH1A1 (0.45) | ALDH1A1HPGDSMN1; SMN2NPSR1L3MBTL1 | |
| SCHEMBL6187172 | 0.86 | CNR2 (0.40) | NPC1RAB9AALDH1A1HPGDSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1043319-B1 | NOVEL ALKYLAMINO DERIVATIVES | MITSUBISHI CHEM CORP (JP) | 2005-03-16 | — | — | EP | disclosed |
| EP-1043319-A1 | NOVEL ALKYLAMINO DERIVATIVES | MITSUBISHI CHEMICAL CORPORATION (JP) | 2000-10-11 | — | — | EP | disclosed |