Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.58 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TACR1 | P25103 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
| ▸ | KLK7 | P49862 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28192047 | 0.85 | KMT2A (0.56) | KMT2ATSHRCYP3A4CYP2C19MEN1 | |
| SCHEMBL206552 | 0.80 | KMT2A (0.49) | KMT2ATSHRMEN1ALDH1A1LMNA | |
| SCHEMBL11991382 | 0.79 | KMT2A (0.61) | KMT2ATSHRCYP3A4MEN1ALDH1A1 | |
| SCHEMBL8505416 | 0.79 | KMT2A (0.61) | KMT2ATSHRCYP3A4MEN1ALDH1A1 | |
| SCHEMBL14624894 | 0.78 | CYP3A4 (0.55) | KMT2ATSHRCYP3A4CYP2C19MEN1 | |
| SCHEMBL13024506 | 0.78 | KMT2A (0.55) | KMT2ACYP3A4CYP2C19MEN1ALDH1A1 | |
| SCHEMBL12789448 | 0.74 | KMT2A (0.48) | KMT2AMEN1ALDH1A1TACR1CYP2D6 | |
| SCHEMBL7415448 | 0.74 | KMT2A (0.43) | KMT2ATSHRCYP3A4CYP2C19MEN1 | |
| SCHEMBL7818496 | 0.73 | KMT2A (0.41) | KMT2ATSHRCYP2C19MEN1ALDH1A1 | |
| SCHEMBL24576212 | 0.73 | KMT2A (0.43) | KMT2ATSHRCYP3A4CYP2C19MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007011910-A2 | CHIRAL AMINE-CATALYZED ASYMMETRIC ADDITION OF CARBON-CENTERED NUCLEOPHILES TO IMINES | TRUSTEES OF BOSTON UNIVERSITY (US) | 2007-01-25 | — | — | WO | disclosed |