Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.64 |
| ▸ | LTA4H | P09960 | 3/20 | 0.42 |
| ▸ | ESR1 | P03372 | 5/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.41 |
| ▸ | CA2 | P00918 | 3/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 5/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 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 | |
|---|---|---|---|---|
| Hydroquinone SCHEMBL60032 | 0.85 | LTA4H (0.52) | LTA4HESR1ESR2CA2CA12 | |
| Hydroquinone SCHEMBL925171 | 0.85 | LTA4H (0.52) | LTA4HESR1ESR2CA2CA12 | |
| Hydroquinone SCHEMBL8536783 | 0.85 | LTA4H (0.52) | LTA4HESR1ESR2CA2CA12 | |
| SCHEMBL23906768 | 0.85 | LTA4H (0.52) | NR1H2LTA4HLMNAMAPTMEN1 | |
| SCHEMBL14368588 | 0.81 | LTA4H (0.68) | NR1H2LTA4HLMNAMAPTMEN1 | |
| Hydroquinone SCHEMBL21647162 | 0.80 | LTA4H (0.48) | LTA4HESR1ESR2CA2CA12 | |
| Hydroquinone SCHEMBL7891403 | 0.80 | LTA4H (0.48) | LTA4HESR1ESR2CA2CA12 | |
| Methoxymethane SCHEMBL10979307 | 0.80 | NR1H2 (0.78) | NR1H2LTA4HESR1ESR2CA2 | |
| Hydroquinone SCHEMBL9418610 | 0.80 | LTA4H (0.48) | LTA4HESR1ESR2CA2CA12 | |
| SCHEMBL29726 | 0.80 | NR1H2 (1.00) | NR1H2ESR1ESR2CA2CA12 |
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-2009072002-A2 | BISPHENOLS IN CANCER THERAPY | UNIVERSITY OF MANITOBA (US) | 2009-06-11 | — | — | WO | disclosed |