Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.48 |
| ▸ | NPC1 | O15118 | 4/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.45 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.45 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 5/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL3068524 | 0.79 | SMN1; SMN2 (0.61) | ALDH1A1CYP3A4TP53LMNAGAA | |
| SCHEMBL7080049 | 0.78 | EPHX1 (0.54) | ALDH1A1CYP3A4SMN1; SMN2NPC1RAB9A | |
| SCHEMBL8739516 | 0.77 | ALDH1A1 (0.64) | ALDH1A1CYP3A4TP53LMNAGAA | |
| SCHEMBL1605352 | 0.77 | ALDH1A1 (0.64) | ALDH1A1CYP3A4TP53LMNAGAA | |
| SCHEMBL1605115 | 0.77 | ALDH1A1 (0.64) | ALDH1A1CYP3A4TP53LMNAGAA | |
| SCHEMBL1528011 | 0.77 | ALDH1A1 (0.64) | ALDH1A1CYP3A4TP53LMNAGAA | |
| SCHEMBL10287540 | 0.77 | EPHX1 (0.50) | ALDH1A1CYP3A4TP53LMNAGAA | |
| SCHEMBL14395633 | 0.74 | — | — | |
| SCHEMBL1475935 | 0.74 | — | — | |
| SCHEMBL3206894 | 0.73 | ALDH1A1 (0.58) | ALDH1A1CYP3A4TP53LMNAGAA |
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-2004065305-A1 | NON-TOXIC CORROSION-PROTECTION PIGMENTS BASED ON MANGANESE | UNIVERSITY OF DAYTON (US) | 2004-08-05 | — | — | WO | disclosed |