Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 5/20 | 0.40 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | NAAA | Q02083 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 2/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1027999 | 0.92 | HSD17B3 (0.41) | CYP1A2LMNAHTTSMN1; SMN2CYP2C19 | |
| SCHEMBL1029024 | 0.87 | LMNA (0.40) | CYP1A2LMNAHTTSMN1; SMN2CYP2C19 | |
| SCHEMBL1026536 | 0.85 | NAAA (0.45) | CYP1A2CYP3A4LMNAHTTSMN1; SMN2 | |
| SCHEMBL1025805 | 0.78 | SMN1; SMN2 (0.46) | CYP1A2LMNAHTTSMN1; SMN2CYP2C19 | |
| SCHEMBL1027198 | 0.78 | MAPT (0.45) | CYP1A2LMNAHTTSMN1; SMN2CYP2C19 | |
| SCHEMBL1025204 | 0.75 | MAPT (0.47) | CYP1A2LMNAHTTSMN1; SMN2CYP2C19 | |
| SCHEMBL3966650 | 0.74 | LMNA (0.56) | CYP1A2LMNAHTTSMN1; SMN2CYP2C19 | |
| SCHEMBL1027788 | 0.73 | LMNA (0.43) | CYP1A2LMNAHTTSMN1; SMN2CYP2C19 | |
| SCHEMBL1023783 | 0.73 | OGG1 (0.54) | CYP1A2CYP3A4LMNAHTTSMN1; SMN2 | |
| SCHEMBL1027263 | 0.72 | TOP2A (0.46) | CYP1A2LMNAHTTSMN1; SMN2CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1608623-B1 | METAL ION CHELATORS AND THERAPEUTIC USE THEREOF | RICHARDSON DESI RAYMOND (AU) | 2011-01-19 | — | — | EP | claimed |