Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR1 | P30556 | 7/20 | 0.74 |
| ▸ | RAB9A | P51151 | 9/20 | 0.67 |
| ▸ | NPC1 | O15118 | 7/20 | 0.67 |
| ▸ | MAPT | P10636 | 4/20 | 0.67 |
| ▸ | GAA | P10253 | 4/20 | 0.67 |
| ▸ | HTT | P42858 | 6/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.63 |
| ▸ | LMNA | P02545 | 5/20 | 0.63 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.60 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.60 |
| ▸ | MEN1 | O00255 | 3/20 | 0.60 |
| ▸ | HPGD | P15428 | 1/20 | 0.60 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.58 |
| ▸ | NCOA3 | Q9Y6Q9 | 2/20 | 0.55 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.55 |
| ▸ | MITF | O75030 | 3/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL1028452 | 0.89 | AGTR1 (0.91) | AGTR1RAB9ANPC1MAPTGAA | |
| SCHEMBL1024477 | 0.87 | AGTR1 (0.72) | AGTR1RAB9ANPC1MAPTGAA | |
| SCHEMBL1025581 | 0.87 | AGTR1 (0.76) | AGTR1RAB9ANPC1MAPTGAA | |
| SCHEMBL27178069 | 0.85 | AGTR1 (1.00) | AGTR1RAB9ANPC1MAPTGAA | |
| SCHEMBL15741850 | 0.85 | AGTR1 (1.00) | AGTR1RAB9ANPC1MAPTGAA | |
| SCHEMBL12720802 | 0.84 | AGTR1 (0.71) | AGTR1RAB9ANPC1MAPTGAA | |
| SCHEMBL12720825 | 0.80 | AGTR1 (0.66) | AGTR1RAB9ANPC1MAPTGAA | |
| SCHEMBL1025876 | 0.79 | RAB9A (0.52) | AGTR1RAB9ANPC1MAPTGAA | |
| SCHEMBL12720823 | 0.79 | AGTR1 (0.88) | AGTR1RAB9ANPC1MAPTGAA | |
| SCHEMBL12955913 | 0.78 | AGTR1 (0.67) | AGTR1RAB9ANPC1MAPTGAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1608623-B1 | METAL ION CHELATORS AND THERAPEUTIC USE THEREOF | RICHARDSON DESI RAYMOND (AU) | 2011-01-19 | — | — | EP | claimed |
| EP-1608623-B1 | METAL ION CHELATORS AND THERAPEUTIC USE THEREOF | RICHARDSON DESI RAYMOND (AU) | 2011-01-19 | — | — | EP | disclosed |