Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.35 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.35 |
| ▸ | MTOR | P42345 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5330894 | 1.00 | ALDH1A1 (0.49) | ALDH1A1MAPTCYP2C19CYP2C9CYP2D6 | |
| SCHEMBL14624818 | 0.88 | ALDH1A1 (0.45) | ALDH1A1MAPTCYP2C19CYP2C9CYP2D6 | |
| SCHEMBL5308650 | 0.86 | ALDH1A1 (0.50) | ALDH1A1MAPTCYP2C19CYP2C9CYP2D6 | |
| SCHEMBL5308646 | 0.86 | ALDH1A1 (0.50) | ALDH1A1MAPTCYP2C19CYP2C9CYP2D6 | |
| SCHEMBL14625121 | 0.86 | ALDH1A1 (0.45) | ALDH1A1MAPTCYP2C19CYP2C9CYP2D6 | |
| SCHEMBL14625355 | 0.86 | CYP3A4 (0.52) | ALDH1A1MAPTCYP2C19CYP2C9CYP2D6 | |
| SCHEMBL14625468 | 0.86 | CYP2C19 (0.48) | ALDH1A1MAPTCYP2C19CYP2C9CYP2D6 | |
| SCHEMBL5307157 | 0.83 | MAPT (0.49) | ALDH1A1MAPTCYP2C19CYP2C9CYP2D6 | |
| SCHEMBL5307158 | 0.83 | MAPT (0.49) | ALDH1A1MAPTCYP2C19CYP2C9CYP2D6 | |
| SCHEMBL14625714 | 0.82 | MAPT (0.48) | ALDH1A1MAPTCYP2C19CYP2D6MEN1 |
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-2007011910-A2 | CHIRAL AMINE-CATALYZED ASYMMETRIC ADDITION OF CARBON-CENTERED NUCLEOPHILES TO IMINES | TRUSTEES OF BOSTON UNIVERSITY (US) | 2007-01-25 | — | — | WO | disclosed |
| WO-2007011910-A2 | CHIRAL AMINE-CATALYZED ASYMMETRIC ADDITION OF CARBON-CENTERED NUCLEOPHILES TO IMINES | TRUSTEES OF BOSTON UNIVERSITY (US) | 2007-01-25 | — | — | WO | disclosed |