Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.35 |
| ▸ | HPRT1 | P00492 | 3/20 | 0.35 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.35 |
| ▸ | FYN | P06241 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | AHR | P35869 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | HPGD | P15428 | 3/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.33 |
| ▸ | GLA | P06280 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.32 |
| ▸ | CYP1A1 | P04798 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL24655322 | 0.91 | CYP1A2 (0.33) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL24472890 | 0.89 | TDP1 (0.37) | CYP1A2HPRT1ERBB2FYNMAOA | |
| SCHEMBL26562004 | 0.88 | SIGMAR1 (0.33) | CYP1A2AHRALDH1A1HPGDHSD17B10 | |
| SCHEMBL26061508 | 0.87 | CYP1A2 (0.39) | CYP1A2HPRT1ERBB2FYNMAOA | |
| SCHEMBL24657837 | 0.86 | AHR (0.32) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL25902787 | 0.86 | ALDH1A1 (0.36) | CYP1A2HPRT1ERBB2FYNMAOA | |
| SCHEMBL22741421 | 0.85 | CYP1A1 (0.32) | CYP1A2FYNAHRHPGDHSD17B10 | |
| SCHEMBL26851575 | 0.84 | TDP1 (0.33) | CYP1A2HPRT1ERBB2FYNMAOA | |
| SCHEMBL26851579 | 0.84 | CYP1A2 (0.37) | CYP1A2HPRT1ERBB2FYNMAOA | |
| SCHEMBL26061135 | 0.84 | HPRT1 (0.34) | CYP1A2HPRT1FYNAHRALDH1A1 |
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-4235829-A1 | ORGANIC LIGHT-EMITTING DEVICE | Lg Chem, Ltd. (KR) | 2023-08-30 | — | — | EP | disclosed |