Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.39 |
| ▸ | HPGD | P15428 | 5/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.39 |
| ▸ | TYMS | P04818 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | CRHBP | P24387 | 1/20 | 0.34 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.34 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2680851 | 0.78 | ALDH1A1 (0.46) | ALDH1A1HPGDHSD17B10CYP3A4TSHR | |
| SCHEMBL18057742 | 0.77 | HSP90AA1 (0.46) | ALDH1A1HPGDHSD17B10CYP3A4TSHR | |
| SCHEMBL1351306 | 0.76 | ALDH1A1 (0.58) | ALDH1A1HPGDHSD17B10CYP3A4TSHR | |
| SCHEMBL28882668 | 0.74 | CYP3A4 (0.33) | ALDH1A1HPGDHSD17B10CYP3A4TSHR | |
| SCHEMBL18600593 | 0.72 | ALDH1A1 (0.52) | ALDH1A1HPGDHSD17B10CYP3A4TSHR | |
| SCHEMBL18600594 | 0.72 | ALDH1A1 (0.52) | ALDH1A1HPGDHSD17B10CYP3A4TSHR | |
| SCHEMBL22990637 | 0.69 | ALDH1A1 (0.61) | ALDH1A1HPGDHSD17B10CYP3A4TSHR | |
| SCHEMBL28351102 | 0.69 | ALDH1A1 (0.62) | ALDH1A1HPGDHSD17B10CYP3A4TSHR | |
| SCHEMBL5045271 | 0.68 | DHFR (0.43) | ALDH1A1HPGDHSD17B10TDP1TYMS | |
| SCHEMBL31746142 | 0.68 | TYMS (0.53) | ALDH1A1HPGDHSD17B10CYP3A4TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1019401-B1 | COMPLEX COMPRISING A RARE-EARTH METAL ION AND A COMPLEXING MOIETY | KONINKL PHILIPS ELECTRONICS NV (NL) | 2008-01-16 | — | — | EP | disclosed |
| EP-1019401-A1 | COMPLEX COMPRISING A RARE-EARTH METAL ION AND A COMPLEXING MOIETY | Akzo Nobel N.V. (NL) | 2000-07-19 | — | — | EP | disclosed |
| WO-1998049163-A1 | COMPLEX COMPRISING A RARE-EARTH METAL ION AND A COMPLEXING MOIETY | AKZO NOBEL N.V. (NL) | 1998-11-05 | — | — | WO | disclosed |