Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL161037 | 0.83 | CYP2C9 (0.35) | TSHRCYP2D6CYP2C19HIF1AALDH1A1 | |
| SCHEMBL769792 | 0.81 | DGAT1 (0.34) | — | |
| SCHEMBL30656499 | 0.81 | ALDH1A1 (0.35) | TSHRALDH1A1 | |
| SCHEMBL979250 | 0.79 | GGT1 (0.38) | ALDH1A1 | |
| SCHEMBL979248 | 0.79 | GGT1 (0.38) | ALDH1A1 | |
| SCHEMBL30656396 | 0.79 | — | — | |
| SCHEMBL16837644 | 0.75 | ALDH1A1 (0.32) | HIF1AALDH1A1 | |
| SCHEMBL2203061 | 0.74 | MAPT (0.31) | — | |
| SCHEMBL15615750 | 0.74 | TDP1 (0.35) | — | |
| SCHEMBL769571 | 0.74 | MCL1 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20040121399-A1 | Substrate bound linker molecules for the construction of biomolecule microarrays | INTERNATIONAL BUSINESS MACHINES CORPORATION | 2004-06-24 | — | — | US | disclosed |