Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.39 |
| ▸ | RAB9A | P51151 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | RELA | Q04206 | 2/20 | 0.37 |
| ▸ | MGAM | O43451 | 1/20 | 0.37 |
| ▸ | SI | P14410 | 1/20 | 0.37 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.37 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.37 |
| ▸ | MBNL1 | Q9NR56 | 1/20 | 0.37 |
| ▸ | DCUN1D1 | Q96GG9 | 2/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 2/20 | 0.35 |
| ▸ | NMUR2 | Q9GZQ4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4511404 | 0.75 | BRD4 (0.38) | NPC1RAB9ASMN1; SMN2L3MBTL1MEN1 | |
| SCHEMBL10263295 | 0.70 | NPC1 (0.42) | NPC1RAB9ASMN1; SMN2GAAL3MBTL1 | |
| SCHEMBL9955370 | 0.70 | NOTUM (0.44) | NPC1RAB9ASMN1; SMN2GAAL3MBTL1 | |
| SCHEMBL9955349 | 0.70 | NOTUM (0.39) | SMN1; SMN2GAAL3MBTL1MGAMSI | |
| SCHEMBL558381 | 0.68 | KDM4E (0.36) | NPC1RAB9ASMN1; SMN2GAAL3MBTL1 | |
| SCHEMBL13960109 | 0.68 | NPC1 (0.44) | NPC1RAB9ASMN1; SMN2GAAL3MBTL1 | |
| SCHEMBL14112980 | 0.68 | NPC1 (0.41) | NPC1RAB9ASMN1; SMN2GAAL3MBTL1 | |
| SCHEMBL9954602 | 0.68 | NPC1 (0.41) | NPC1RAB9ASMN1; SMN2GAAL3MBTL1 | |
| SCHEMBL29001802 | 0.67 | MEN1 (0.36) | NPC1RAB9ASMN1; SMN2L3MBTL1MEN1 | |
| SCHEMBL9956367 | 0.66 | RAB9A (0.42) | NPC1RAB9ASMN1; SMN2GAAL3MBTL1 |
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-2012085852-A1 | 3,8-DIAZA-BICYCLO[4.2.0]OCT-8-YL AMIDES | ACTELION PHARMACEUTICALS LTD (CH) | 2012-06-28 | — | — | WO | disclosed |
| WO-2012085857-A1 | 3,8-DIAZA-BICYCLO[4.2.0]OCT-3-YL AMIDES | ACTELION PHARMACEUTICALS LTD (CH) | 2012-06-28 | — | — | WO | disclosed |