Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 0.77 |
| ▸ | FYN | P06241 | 2/20 | 0.77 |
| ▸ | ACHE | P22303 | 2/20 | 0.77 |
| ▸ | AHR | P35869 | 2/20 | 0.77 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.77 |
| ▸ | MAOA | P21397 | 1/20 | 0.77 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.67 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.67 |
| ▸ | HPGD | P15428 | 4/20 | 0.67 |
| ▸ | THRB | P10828 | 1/20 | 0.67 |
| ▸ | HPRT1 | P00492 | 4/20 | 0.58 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.54 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 4/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.50 |
| ▸ | LCK | P06239 | 1/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL4847355 | 1.00 | CYP1A2 (0.77) | CYP1A2FYNACHEAHRERBB2 | |
| SCHEMBL4849370 | 0.94 | CYP1A2 (0.75) | CYP1A2FYNACHEAHRERBB2 | |
| SCHEMBL4853263 | 0.94 | HPRT1 (0.67) | CYP1A2FYNACHEAHRERBB2 | |
| SCHEMBL5481478 | 0.92 | CYP1A2 (0.66) | CYP1A2FYNACHEAHRERBB2 | |
| SCHEMBL4849418 | 0.92 | CYP1A2 (0.71) | CYP1A2FYNACHEAHRERBB2 | |
| Benzo[Def]Chrysene SCHEMBL17008909 | 0.92 | CYP1A2 (0.92) | CYP1A2FYNACHEAHRERBB2 | |
| Benzo[Def]Chrysene SCHEMBL21328003 | 0.92 | CYP1A2 (0.92) | CYP1A2FYNACHEAHRERBB2 | |
| SCHEMBL5413311 | 0.91 | ALDH1A1 (0.71) | CYP1A2FYNACHEAHRERBB2 | |
| SCHEMBL4845505 | 0.90 | CYP1A2 (0.81) | CYP1A2FYNACHEAHRERBB2 | |
| Dibenz[A,H]Anthracene SCHEMBL25398496 | 0.90 | CYP1A2 (0.88) | CYP1A2FYNACHEAHRERBB2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7470290-B2 | Hydroscopic polymer gels for easier cleaning | THE CLOROX COMPANY (US) | 2008-12-30 | — | — | US | disclosed |
| US-20050245428-A1 | Hydroscopic polymer gels for easier cleaning | RODRIGUES KLIN A | 2005-11-03 | — | — | US | disclosed |