Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CPB2 | Q96IY4 | 11/20 | 0.38 |
| ▸ | CPB1 | P15086 | 4/20 | 0.38 |
| ▸ | GRIA1 | P42261 | 3/20 | 0.37 |
| ▸ | GRIA3 | P42263 | 3/20 | 0.37 |
| ▸ | GRIA4 | P48058 | 3/20 | 0.37 |
| ▸ | GRIA2 | P42262 | 2/20 | 0.37 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.35 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.35 |
| ▸ | GRIK5 | Q16478 | 1/20 | 0.35 |
| ▸ | ALPI | P09923 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | XIAP | P98170 | 1/20 | 0.35 |
| ▸ | SLC7A5 | Q01650 | 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 | |
|---|---|---|---|---|
| SCHEMBL10108842 | 0.87 | CYP1A2 (0.41) | CYP1A2CPB2CPB1GRIA1GRIA3 | |
| SCHEMBL2769348 | 0.78 | CYP1A2 (0.37) | CYP1A2CPB2CPB1GRIA1GRIA3 | |
| SCHEMBL3839522 | 0.77 | SIRT2 (0.49) | CYP1A2CPB2CPB1ALPIPKM | |
| SCHEMBL6773700 | 0.77 | SIRT2 (0.49) | CYP1A2CPB2CPB1ALPIPKM | |
| SCHEMBL21690129 | 0.77 | SIRT2 (0.49) | CYP1A2CPB2CPB1ALPIPKM | |
| SCHEMBL52216 | 0.76 | CYP2C9 (0.47) | CYP1A2CPB2CPB1GRIA1GRIA3 | |
| SCHEMBL28977985 | 0.76 | SLC7A5 (0.44) | CYP1A2CPB2CPB1GRIA1GRIA3 | |
| SCHEMBL52215 | 0.76 | CYP2C9 (0.47) | CYP1A2CPB2CPB1GRIA1GRIA3 | |
| SCHEMBL7001068 | 0.76 | SLC7A5 (0.44) | CYP1A2CPB2CPB1GRIA1GRIA3 | |
| SCHEMBL28977981 | 0.76 | SLC7A5 (0.44) | CYP1A2CPB2CPB1GRIA1GRIA3 |
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-1618380-B1 | N epsilon AND/OR N alpha DERIVATIZED, METAL AND ORGANIC PROTECTED L-HISTIDINE FOR COUPLING TO BIOMOLECULES FOR HIGHLY EFFICIENT LABELING WITH (M(OH2)3(CO)3)+ BY FAC COORDINATION | UNIV ZUERICH (CH) | 2009-12-30 | — | — | EP | disclosed |