Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.46 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.46 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.45 |
| ▸ | LTA4H | P09960 | 1/20 | 0.44 |
| ▸ | LAP3 | P28838 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL16672469 | 0.80 | ALDH1A1 (0.49) | ALDH1A1MAPK1TDP1L3MBTL1CYP3A4 | |
| SCHEMBL17724429 | 0.80 | ALDH1A1 (0.49) | ALDH1A1MAPK1TDP1L3MBTL1CYP3A4 | |
| SCHEMBL4649681 | 0.79 | CA12 (0.56) | ALDH1A1MAPK1TDP1L3MBTL1CYP3A4 | |
| SCHEMBL24205786 | 0.79 | MAPT (0.48) | ALDH1A1MAPK1TDP1L3MBTL1CYP3A4 | |
| SCHEMBL24205766 | 0.79 | MAPT (0.48) | ALDH1A1MAPK1TDP1L3MBTL1CYP3A4 | |
| SCHEMBL23810968 | 0.79 | MAPT (0.48) | ALDH1A1MAPK1TDP1L3MBTL1CYP3A4 | |
| SCHEMBL30844637 | 0.78 | ALDH1A1 (0.46) | ALDH1A1MAPK1TDP1L3MBTL1CYP3A4 | |
| SCHEMBL12869905 | 0.78 | ALDH1A1 (0.53) | ALDH1A1MAPK1TDP1L3MBTL1CYP3A4 | |
| SCHEMBL3096935 | 0.78 | ALDH1A1 (0.53) | ALDH1A1MAPK1TDP1L3MBTL1CYP3A4 | |
| SCHEMBL2136782 | 0.77 | ALDH1A1 (0.56) | ALDH1A1MAPK1TDP1L3MBTL1CYP3A4 |
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-2020198055-A1 | ALLOSTERIC BCR-ABL PROTEOLYSIS TARGETING CHIMERIC COMPOUNDS | YALE UNIVERSITY (US) | 2020-10-01 | — | — | WO | disclosed |