Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 7/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.33 |
| ▸ | SQOR | Q9Y6N5 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.32 |
| ▸ | CCR1 | P32246 | 1/20 | 0.32 |
| ▸ | CCR5 | P51681 | 1/20 | 0.32 |
| ▸ | CCR8 | P51685 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL21861168 | 0.81 | MCL1 (0.40) | MCL1ALDH1A1NPSR1RXFP1HSP90AA1 | |
| SCHEMBL21849866 | 0.74 | CCR1 (0.55) | MCL1ALDH1A1NPSR1RXFP1HSP90AA1 | |
| SCHEMBL29505007 | 0.74 | CCR1 (0.55) | MCL1ALDH1A1NPSR1RXFP1HSP90AA1 | |
| SCHEMBL3596420 | 0.74 | CCR1 (0.55) | MCL1ALDH1A1NPSR1RXFP1HSP90AA1 | |
| SCHEMBL30943430 | 0.74 | CCR1 (0.55) | MCL1ALDH1A1NPSR1RXFP1HSP90AA1 | |
| SCHEMBL30943427 | 0.74 | CCR1 (0.55) | MCL1ALDH1A1NPSR1RXFP1HSP90AA1 | |
| SCHEMBL21743331 | 0.72 | HSP90AA1 (0.35) | MCL1ALDH1A1HSP90AA1SQORL3MBTL1 | |
| SCHEMBL19313756 | 0.71 | SLC2A1 (0.31) | HSP90AA1SQORSLC2A1CCR1CCR5 | |
| SCHEMBL3320940 | 0.71 | CCR1 (0.51) | MCL1ALDH1A1HSP90AA1L3MBTL1GAA | |
| SCHEMBL4401831 | 0.69 | MCL1 (0.56) | MCL1ALDH1A1HSP90AA1L3MBTL1CCR1 |
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-2020067593-A1 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | 희성소재(주) | 2020-04-02 | — | — | WO | disclosed |