Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.53 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.53 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.53 |
| ▸ | CYP2A6 | P11509 | 6/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.50 |
| ▸ | NQO1 | P15559 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | NQO2 | P16083 | 1/20 | 0.45 |
| ▸ | ESR1 | P03372 | 2/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL190942 | 0.96 | ALDH1A1 (0.56) | ALDH1A1HSD17B10HIF1ACYP1B1CYP2A6 | |
| SCHEMBL29423353 | 0.96 | ALDH1A1 (0.56) | ALDH1A1HSD17B10HIF1ACYP1B1CYP2A6 | |
| SCHEMBL28463321 | 0.96 | ALDH1A1 (0.56) | ALDH1A1HSD17B10HIF1ACYP1B1CYP2A6 | |
| Anthracene SCHEMBL28787108 | 0.92 | ALDH1A1 (0.53) | ALDH1A1HSD17B10HIF1ACYP1B1CYP2A6 | |
| Benzo[B]Triphenylene SCHEMBL29374595 | 0.89 | ALDH1A1 (0.58) | ALDH1A1HSD17B10HIF1ACYP1B1CYP2A6 | |
| Benzo[B]Triphenylene SCHEMBL29628013 | 0.89 | ALDH1A1 (0.58) | ALDH1A1HSD17B10HIF1ACYP1B1CYP2A6 | |
| SCHEMBL4855544 | 0.89 | ALDH1A1 (0.58) | ALDH1A1HSD17B10HIF1ACYP1B1CYP2A6 | |
| Benzo[B]Triphenylene SCHEMBL71635 | 0.89 | ALDH1A1 (0.58) | ALDH1A1HSD17B10HIF1ACYP1B1CYP2A6 | |
| Benzo[B]Triphenylene SCHEMBL17537048 | 0.86 | ALDH1A1 (0.55) | ALDH1A1HSD17B10HIF1ACYP1B1CYP2A6 | |
| SCHEMBL415471 | 0.86 | ALDH1A1 (0.55) | ALDH1A1HSD17B10HIF1ACYP1B1CYP2A6 |
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 |