Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | AHR | P35869 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.31 |
| ▸ | MEN1 | O00255 | 3/20 | 0.31 |
| ▸ | MAPT | P10636 | 3/20 | 0.31 |
| ▸ | HPGD | P15428 | 3/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | ALPI | P09923 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | CASP3 | P42574 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | CASP7 | P55210 | 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 | |
|---|---|---|---|---|
| SCHEMBL22356411 | 0.92 | AHR (0.39) | ALDH1A1NPSR1RXFP1AHRKDM4E | |
| SCHEMBL21889618 | 0.92 | AHR (0.40) | ALDH1A1NPSR1RXFP1AHRKDM4E | |
| SCHEMBL21889623 | 0.91 | ALDH1A1 (0.38) | ALDH1A1NPSR1RXFP1AHRKDM4E | |
| SCHEMBL22356410 | 0.90 | AHR (0.41) | ALDH1A1NPSR1RXFP1AHRKDM4E | |
| SCHEMBL21717967 | 0.88 | ALDH1A1 (0.40) | ALDH1A1NPSR1RXFP1AHRKDM4E | |
| SCHEMBL21717981 | 0.88 | AHR (0.40) | ALDH1A1NPSR1RXFP1AHRKDM4E | |
| SCHEMBL23109687 | 0.88 | ALOX5 (0.35) | — | |
| SCHEMBL21717526 | 0.87 | AHR (0.39) | ALDH1A1NPSR1RXFP1AHRKDM4E | |
| SCHEMBL21717902 | 0.87 | AHR (0.41) | ALDH1A1NPSR1RXFP1AHRKDM4E | |
| SCHEMBL21889619 | 0.87 | AHR (0.40) | ALDH1A1NPSR1RXFP1AHRKDM4E |
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-11527720-B1 | Organic electroluminescence device, electronic device, and compound | IDEMITSU KOSAN CO., LTD. (JP) | 2022-12-13 | — | — | US | disclosed |