Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | HTR6 | P50406 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5332532 | 0.98 | KMT2A (0.33) | KMT2AALDH1A1LMNAPOLBKDM4E | |
| Hydrochloric Acid SCHEMBL4261145 | 0.98 | KMT2A (0.33) | KMT2AALDH1A1LMNAPOLBKDM4E | |
| SCHEMBL5519099 | 0.80 | HRH3 (0.35) | KMT2AALDH1A1LMNACYP2C19MAPK1 | |
| Hydrochloric Acid SCHEMBL6000644 | 0.76 | ALDH1A1 (0.41) | KMT2AALDH1A1LMNAPOLBCYP2C19 | |
| SCHEMBL25352333 | 0.75 | HRH3 (0.45) | ALDH1A1L3MBTL3L3MBTL1 | |
| SCHEMBL14423646 | 0.73 | KMT2A (0.33) | KMT2AALDH1A1LMNAPOLBKDM4E | |
| SCHEMBL25187419 | 0.73 | L3MBTL3 (0.40) | KMT2AALDH1A1LMNAKDM4ECYP2C19 | |
| SCHEMBL27373110 | 0.73 | L3MBTL3 (0.36) | ALDH1A1LMNAL3MBTL3L3MBTL1 | |
| SCHEMBL2272753 | 0.71 | HTR6 (0.34) | HTR6 | |
| SCHEMBL23023308 | 0.71 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1636221-B1 | 3-Heterocyclyl-Azetidine compounds useful as NK1/NK2 receptors antagonists | ALBIREO AB (SE) | 2009-08-12 | — | — | EP | disclosed |
| US-7402581-B2 | Azetidine compounds | ALBIREO AB (SE) | 2008-07-22 | — | — | US | disclosed |
| US-7402581-B2 | Azetidine compounds | ALBIREO AB (SE) | 2008-07-22 | — | — | US | disclosed |