Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 3/20 | 0.46 |
| ▸ | TTR | P02766 | 3/20 | 0.44 |
| ▸ | CYP1A1 | P04798 | 5/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.43 |
| ▸ | CYP1B1 | Q16678 | 5/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.40 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.39 |
| ▸ | PRKDC | P78527 | 1/20 | 0.39 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1319784 | 0.81 | PRKDC (0.55) | CYP1A1CYP1A2CYP1B1MAPTNR3C2 | |
| SCHEMBL29677981 | 0.81 | PRKDC (0.55) | CYP1A1CYP1A2CYP1B1MAPTNR3C2 | |
| SCHEMBL27861122 | 0.79 | LOXL2 (0.58) | CYP1A2MAPTNR3C2GPR35ACHE | |
| SCHEMBL21959063 | 0.76 | CSNK2A2 (0.48) | AHRCYP1A1CYP1A2CYP1B1MAPT | |
| SCHEMBL1320093 | 0.76 | ALDH1A1 (0.39) | CYP1A1CYP1A2CYP1B1MAPTNR3C2 | |
| SCHEMBL28592427 | 0.76 | ALDH1A1 (0.64) | CYP1A1CYP1A2CYP1B1MAPTPRKDC | |
| SCHEMBL12325495 | 0.75 | LOXL2 (0.47) | AHRTTRCYP1A1CYP1A2CYP1B1 | |
| SCHEMBL5564222 | 0.75 | GPR35 (0.61) | TTRGPR35PTGS1KDM4EALDH1A1 | |
| SCHEMBL9160788 | 0.75 | CYP1A2 (0.40) | CYP1A1CYP1A2CYP1B1MAPTNR3C2 | |
| SCHEMBL31217606 | 0.75 | PRKDC (0.57) | CYP1A1CYP1A2CYP1B1MAPTPRKDC |
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-2020079106-A1 | CHROMEN-4-ONE DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS DISEASE | F. HOFFMANN-LA ROCHE AG (CH) | 2020-04-23 | — | — | WO | disclosed |