Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | CCR3 | P51677 | 1/20 | 0.47 |
| ▸ | CCR5 | P51681 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL4035567 | 0.89 | LMNA (0.48) | ALDH1A1CYP3A4CYP2D6KMT2APOLB | |
| SCHEMBL3920476 | 0.85 | ALDH1A1 (0.52) | ALDH1A1SMN1; SMN2CYP3A4CYP2D6MAPK1 | |
| SCHEMBL4041475 | 0.83 | MMP2 (0.39) | ALDH1A1SMN1; SMN2KMT2ATSHRLMNA | |
| SCHEMBL3927380 | 0.83 | CYP2D6 (0.45) | ALDH1A1SMN1; SMN2CYP3A4CYP2D6MAPK1 | |
| SCHEMBL4038204 | 0.81 | EPHX2 (0.47) | ALDH1A1CYP3A4CYP2D6MAPK1KMT2A | |
| SCHEMBL4034055 | 0.81 | L3MBTL1 (0.45) | ALDH1A1MAPK1KMT2APOLBTSHR | |
| SCHEMBL4032408 | 0.80 | ALDH1A1 (0.52) | ALDH1A1SMN1; SMN2CYP3A4CYP2D6KMT2A | |
| SCHEMBL4041414 | 0.80 | KMT2A (0.46) | ALDH1A1SMN1; SMN2MAPK1KMT2AHPGD | |
| SCHEMBL2942516 | 0.79 | SMN1; SMN2 (0.48) | ALDH1A1SMN1; SMN2CYP3A4KMT2AHPGD | |
| SCHEMBL4042839 | 0.79 | KMT2A (0.46) | ALDH1A1SMN1; SMN2KMT2APOLBLMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1730144-B1 | SUBSTITUTED 1,4,8-TRIAZASPIRO¬4.5 DECAN-2-ONE COMPOUNDS | GRUENENTHAL GMBH (DE) | 2009-06-10 | — | — | EP | claimed |