Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 4/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.41 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL12017092 | 0.84 | CYP2A6 (0.43) | CYP2A6CYP1A2TSHRHPRT1ALDH1A1 | |
| SCHEMBL14902935 | 0.84 | CYP2A6 (0.45) | CYP2A6CYP1A2TSHRHPRT1ALDH1A1 | |
| SCHEMBL24175934 | 0.81 | CYP2A6 (0.47) | CYP2A6CYP1A2TSHRHPRT1ALDH1A1 | |
| SCHEMBL24449220 | 0.78 | CYP1A2 (0.39) | CYP2A6CYP1A2TSHRHPRT1ALDH1A1 | |
| SCHEMBL29360084 | 0.78 | CYP1A2 (0.56) | CYP2A6CYP1A2TSHRALDH1A1HSD17B10 | |
| SCHEMBL119090 | 0.78 | CYP1A2 (0.56) | CYP2A6CYP1A2TSHRALDH1A1HSD17B10 | |
| SCHEMBL14596475 | 0.77 | HSD17B10 (0.42) | CYP2A6CYP1A2TSHRHPRT1ALDH1A1 | |
| SCHEMBL25579723 | 0.77 | ALDH1A1 (0.41) | CYP2A6CYP1A2TSHRHPRT1ALDH1A1 | |
| SCHEMBL459684 | 0.76 | CYP1A2 (0.56) | CYP2A6CYP1A2TSHRALDH1A1HSD17B10 | |
| SCHEMBL24713061 | 0.76 | CYP1A2 (0.50) | CYP2A6CYP1A2TSHRHPRT1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4001286-A1 | ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES | Universal Display Corporation (US) | 2022-05-25 | — | — | EP | disclosed |