Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | MAPT | P10636 | 6/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | GAA | P10253 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | SCN1A | P35498 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.34 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.34 |
| ▸ | GHSR | Q92847 | 1/20 | 0.34 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.34 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL19057297 | 0.92 | ALDH1A1 (0.46) | ALDH1A1MAPTKMT2ASMN1; SMN2GAA | |
| SCHEMBL19057230 | 0.91 | ALDH1A1 (0.47) | ALDH1A1MAPTKMT2ASMN1; SMN2GAA | |
| SCHEMBL13339932 | 0.87 | SMN1; SMN2 (0.37) | ALDH1A1MAPTKMT2ASMN1; SMN2GAA | |
| SCHEMBL13367283 | 0.87 | ALDH1A1 (0.50) | ALDH1A1MAPTKMT2ASMN1; SMN2CYP1A2 | |
| SCHEMBL19057228 | 0.86 | ALDH1A1 (0.46) | ALDH1A1MAPTKMT2ASMN1; SMN2GAA | |
| SCHEMBL17980866 | 0.85 | ALDH1A1 (0.41) | ALDH1A1MAPTKMT2ASMN1; SMN2GAA | |
| SCHEMBL15613436 | 0.85 | MAPT (0.50) | ALDH1A1MAPTKMT2ASMN1; SMN2CYP1A2 | |
| SCHEMBL15613407 | 0.85 | ALDH1A1 (0.40) | ALDH1A1MAPTKMT2ASMN1; SMN2GAA | |
| SCHEMBL17981704 | 0.83 | ALDH1A1 (0.42) | ALDH1A1MAPTKMT2ASMN1; SMN2GAA | |
| SCHEMBL15613424 | 0.83 | MAPT (0.47) | ALDH1A1MAPTKMT2ASMN1; SMN2CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7718781-B2 | Hydroxypyridonate and hydroxypyrimidinone chelating agents | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2010-05-18 | — | — | US | disclosed |
| WO-2007121453-A2 | 2-HYDROXY-1-OXO 1,2 DIHYDRO ISOQUINOLINE CHELATING AGENTS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2007-10-25 | — | — | WO | disclosed |