Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TYR | P14679 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | TAS2R38 | P59533 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 4/20 | 0.38 |
| ▸ | GAA | P10253 | 4/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CRHBP | P24387 | 1/20 | 0.35 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9446580 | 0.83 | ALDH1A1 (0.51) | ALDH1A1SMN1; SMN2TP53TYRTSHR | |
| SCHEMBL28059480 | 0.83 | ALDH1A1 (0.45) | ALDH1A1SMN1; SMN2TP53TYRTSHR | |
| Water SCHEMBL28266025 | 0.81 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2TP53TYRTSHR | |
| SCHEMBL11598307 | 0.79 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2TP53TYRTSHR | |
| SCHEMBL9615041 | 0.77 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2TP53TYRTSHR | |
| SCHEMBL27839869 | 0.75 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2TP53TYRTSHR | |
| SCHEMBL3797066 | 0.74 | KMT2A (0.59) | ALDH1A1SMN1; SMN2TP53TYRTSHR | |
| SCHEMBL9082914 | 0.72 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2TP53TYRTSHR | |
| SCHEMBL3833570 | 0.71 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2TP53TSHRKMT2A | |
| SCHEMBL11875734 | 0.71 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2TP53TYRTSHR |
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-2014086478-A1 | INHIBITORS OF MALT1 PROTEASE | Helmholtz Zentrum München - Deutsches Forschungszentrum für Gesundheit und Umwelt (GmbH) (DE) | 2014-06-12 | — | — | WO | disclosed |