Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 8/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.32 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.32 |
| ▸ | SQOR | Q9Y6N5 | 2/20 | 0.32 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL21743331 | 0.91 | HSP90AA1 (0.35) | MCL1ALDH1A1HSP90AA1MAPTKDM4E | |
| SCHEMBL19313649 | 0.87 | TRPV1 (0.33) | HSP90AA1KDM4ELMNATDP1SQOR | |
| SCHEMBL24762515 | 0.84 | CNR2 (0.32) | MCL1HSP90AA1KDM4ELMNAHTT | |
| SCHEMBL25887036 | 0.84 | HIF1A (0.34) | ALDH1A1HSP90AA1KDM4ELMNAHTT | |
| SCHEMBL21860923 | 0.81 | MCL1 (0.40) | MCL1NPSR1RXFP1ALDH1A1HSP90AA1 | |
| SCHEMBL23176879 | 0.80 | SIRT2 (0.36) | NPSR1ALDH1A1HSP90AA1MAPTKDM4E | |
| SCHEMBL23764098 | 0.76 | — | — | |
| SCHEMBL21935789 | 0.76 | MAPK1 (0.30) | RAB9ANPC1 | |
| SCHEMBL22066176 | 0.74 | METAP1 (0.32) | NPSR1HSP90AA1MAPTKDM4ELMNA | |
| SCHEMBL21849866 | 0.74 | CCR1 (0.55) | MCL1NPSR1RXFP1ALDH1A1HSP90AA1 |
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 |