Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 5/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | G6PD | P11413 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | CCR6 | P51684 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL36472 | 0.98 | ESR1 (0.43) | ESR1ALDH1A1ALOX15TDP1HSD17B10 | |
| SCHEMBL27905066 | 0.98 | ESR1 (0.43) | ESR1ALDH1A1ALOX15TDP1HSD17B10 | |
| SCHEMBL29359879 | 0.98 | ESR1 (0.43) | ESR1ALDH1A1ALOX15TDP1HSD17B10 | |
| Ammonia Solution, Strong SCHEMBL27875529 | 0.95 | ESR1 (0.41) | ESR1ALDH1A1ALOX15TDP1HSD17B10 | |
| Water SCHEMBL28289219 | 0.95 | ESR1 (0.41) | ESR1ALDH1A1ALOX15TDP1HSD17B10 | |
| SCHEMBL27631075 | 0.95 | ESR1 (0.41) | ESR1ALDH1A1ALOX15TDP1HSD17B10 | |
| Methane SCHEMBL27888108 | 0.95 | ESR1 (0.41) | ESR1ALDH1A1ALOX15TDP1HSD17B10 | |
| SCHEMBL28885893 | 0.91 | ESR1 (0.39) | ESR1ALDH1A1ALOX15TDP1HSD17B10 | |
| SCHEMBL27961824 | 0.89 | ESR1 (0.38) | ESR1ALDH1A1ALOX15TDP1HSD17B10 | |
| Dimethyl Sulfoxide SCHEMBL29001007 | 0.87 | ESR1 (0.36) | ESR1ALDH1A1ALOX15TDP1HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-5599651-A | CONTAINING AT LEAST ONE ACRYLATE GROUP; COATINGS, ADHESIVES, PHOTORESISTS AND STEREOLITHOGRAPHY; GOOD STRENGTH | CIBA-GEIGY CORPORATION (US) | 1997-02-04 | — | — | US | disclosed |