Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 3/20 | 0.37 |
| ▸ | RAPGEF4 | Q8WZA2 | 2/20 | 0.36 |
| ▸ | JUN | P05412 | 3/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.35 |
| ▸ | RELA | Q04206 | 3/20 | 0.35 |
| ▸ | XPO1 | O14980 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | XBP1 | P17861 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | PDE2A | O00408 | 1/20 | 0.32 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.32 |
| ▸ | AGPAT2 | O15120 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.31 |
| ▸ | KDR | P35968 | 1/20 | 0.31 |
| ▸ | TNKS | O95271 | 1/20 | 0.31 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.31 |
| ▸ | PARP2 | Q9UGN5 | 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 | |
|---|---|---|---|---|
| SCHEMBL20660532 | 1.00 | APP (0.37) | APPRAPGEF4JUNNFKB1NFKB2 | |
| SCHEMBL23690319 | 0.84 | KIF20B (0.38) | APPJUNNFKB1NFKB2RELA | |
| SCHEMBL29656421 | 0.83 | CACNA1H (0.39) | APPJUNNFKB1NFKB2RELA | |
| SCHEMBL23301032 | 0.83 | CACNA1H (0.39) | APPJUNNFKB1NFKB2RELA | |
| SCHEMBL30762122 | 0.81 | DDR1 (0.36) | APPJUNNFKB1NFKB2RELA | |
| SCHEMBL4172267 | 0.78 | PARP1 (0.44) | MAPTXBP1HTTALDH1A1SMN1; SMN2 | |
| SCHEMBL27101009 | 0.78 | PDE10A (0.36) | HTTALDH1A1PDE10A | |
| SCHEMBL4184952 | 0.75 | DHODH (0.41) | HTTALDH1A1EGFRPARP2TP53 | |
| SCHEMBL23690320 | 0.75 | PDE2A (0.38) | NFKB1NFKB2RELAMAPTPDE2A | |
| SCHEMBL26511897 | 0.73 | AR (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-111683950-B | AhR modulators | 伊迪亚生物科学有限公司 | 2024-04-16 | — | — | CN | disclosed |