Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | HPGD | P15428 | 4/20 | 0.41 |
| ▸ | GAA | P10253 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | SCN1A | P35498 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.41 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.41 |
| ▸ | GHSR | Q92847 | 1/20 | 0.41 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.41 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL13367279 | 0.86 | CNR2 (0.39) | ALDH1A1SMN1; SMN2HTTCNR2LIPG | |
| SCHEMBL13339929 | 0.84 | LIPG (0.41) | KDM4EALDH1A1HPGDGAASMN1; SMN2 | |
| SCHEMBL15119487 | 0.81 | CNR2 (0.40) | KDM4EALDH1A1HPGDGAASMN1; SMN2 | |
| SCHEMBL16350307 | 0.79 | LIPG (0.37) | ALDH1A1SMN1; SMN2HTTCNR2LIPG | |
| SCHEMBL13367285 | 0.79 | ALDH1A1 (0.39) | KDM4EALDH1A1HPGDGAASMN1; SMN2 | |
| SCHEMBL14402636 | 0.78 | ALOX5 (0.39) | ALDH1A1SMN1; SMN2HTTALOX15CNR2 | |
| SCHEMBL19400045 | 0.78 | LIPG (0.48) | KDM4EALDH1A1HPGDGAASMN1; SMN2 | |
| SCHEMBL6864646 | 0.78 | LIPG (0.45) | KDM4EALDH1A1HPGDGAASMN1; SMN2 | |
| SCHEMBL15119492 | 0.77 | CNR2 (0.41) | KDM4EALDH1A1HPGDGAASMN1; SMN2 | |
| SCHEMBL15119427 | 0.76 | DRD2 (0.34) | KDM4EALDH1A1HPGDGAASMN1; SMN2 |
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 |