Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
| ▸ | POLB | P06746 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.58 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | PDE4A | P27815 | 1/20 | 0.31 |
| ▸ | ANO1 | Q5XXA6 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23573325 | 0.98 | MEN1 (0.61) | MEN1POLBKMT2ATHRBPDE4A | |
| SCHEMBL14893926 | 0.91 | — | — | |
| SCHEMBL3329673 | 0.78 | MEN1 (0.65) | MEN1POLBKMT2ATHRBPDE4A | |
| SCHEMBL3831093 | 0.77 | CTSL (0.45) | MEN1POLBKMT2A | |
| SCHEMBL17768510 | 0.76 | MEN1 (0.35) | MEN1POLBKMT2A | |
| SCHEMBL3332204 | 0.75 | MEN1 (0.61) | MEN1POLBKMT2ATHRBPDE4A | |
| SCHEMBL19900848 | 0.74 | MEN1 (0.34) | MEN1POLBKMT2A | |
| SCHEMBL22362841 | 0.74 | MEN1 (0.35) | MEN1POLBKMT2A | |
| SCHEMBL12666587 | 0.74 | MEN1 (0.59) | MEN1POLBKMT2ATHRBPDE4A | |
| SCHEMBL17469171 | 0.74 | MEN1 (0.59) | MEN1POLBKMT2ATHRBPDE4A |
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-3740473-A1 | SUBSTITUTED ALKYNYLENE COMPOUNDS AS ANTICANCER AGENTS | Aurigene Discovery Technologies Limited (IN) | 2020-11-25 | — | — | EP | disclosed |
| WO-2019142126-A1 | SUBSTITUTED ALKYNYLENE COMPOUNDS AS ANTICANCER AGENTS | AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) | 2019-07-25 | — | — | WO | disclosed |