Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.39 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.39 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | GRIK5 | Q16478 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TYMP | P19971 | 7/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | TK1 | P04183 | 4/20 | 0.34 |
| ▸ | PYGM | P11217 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | MET | P08581 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL12463863 | 1.00 | CYP1A2 (0.39) | CYP1A2GRIA1GRIA2GRIA4BLM | |
| SCHEMBL15948684 | 0.85 | TYMP (0.42) | BLMTYMPSMN1; SMN2TK1ALDH1A1 | |
| SCHEMBL15740172 | 0.85 | CYP1A2 (0.42) | CYP1A2GRIA1GRIA2GRIA4BLM | |
| SCHEMBL22047282 | 0.80 | CYP1A2 (0.41) | CYP1A2GRIA1GRIA2GRIA4BLM | |
| SCHEMBL14143203 | 0.76 | POLB (0.47) | HSD17B10ALDH1A1 | |
| SCHEMBL17772358 | 0.74 | TYMP (0.41) | BLMTYMPTK1ALDH1A1CYP2C19 | |
| SCHEMBL12747301 | 0.71 | CYP1A2 (0.41) | CYP1A2GRIA1GRIA2GRIA4BLM | |
| SCHEMBL24564759 | 0.71 | SMN1; SMN2 (0.42) | CYP1A2KMT2ATYMPSMN1; SMN2TK1 | |
| SCHEMBL19033291 | 0.69 | CYP1A2 (0.41) | CYP1A2GRIA1GRIA2GRIA4BLM | |
| SCHEMBL13071348 | 0.68 | BLM (0.47) | CYP1A2GRIA1GRIA2GRIA4BLM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008052775-A2 | CLICK CHEMISTRY FOR THE PRODUCTION OF REPORTER MOLECULES | BASECLICK GMBH (DE) | 2008-05-08 | — | — | WO | disclosed |