Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.61 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | ESR1 | P03372 | 4/20 | 0.52 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.52 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.48 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.48 |
| ▸ | CA3 | P07451 | 1/20 | 0.48 |
| ▸ | CA4 | P22748 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL225296 | 0.86 | HSD17B10 (0.56) | TDP1HSD17B10CYP3A4ALOX15TSHR | |
| SCHEMBL29791497 | 0.86 | HSD17B10 (0.56) | TDP1HSD17B10CYP3A4ALOX15TSHR | |
| SCHEMBL29636773 | 0.84 | HSD17B10 (0.60) | TDP1HSD17B10CYP3A4ALOX15TSHR | |
| Anthracene SCHEMBL27913215 | 0.81 | CA2 (0.65) | TDP1HSD17B10CYP3A4CYP1A2ESR1 | |
| Betanaphthol SCHEMBL19547908 | 0.79 | CYP1A2 (0.85) | TDP1HSD17B10CYP3A4ALOX15TSHR | |
| SCHEMBL27309441 | 0.79 | HSD17B10 (0.54) | TDP1HSD17B10CYP3A4ALOX15TSHR | |
| Anthracene SCHEMBL21624994 | 0.78 | CA12 (0.69) | TDP1HSD17B10CYP3A4TSHRCYP1A2 | |
| Anthracene SCHEMBL4631043 | 0.78 | CA12 (0.69) | TDP1HSD17B10CYP3A4TSHRCYP1A2 | |
| Naphthalene SCHEMBL8469776 | 0.78 | CA12 (0.79) | TDP1HSD17B10CYP3A4ALOX15HIF1A | |
| Naphthalene SCHEMBL9480479 | 0.78 | CA12 (0.79) | TDP1HSD17B10CYP3A4ALOX15HIF1A |
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 |
|---|---|---|---|---|---|---|---|
| CN-102143984-A | Polymerizable compound for optical material, optical material, and optical material manufacturing method | MITSUI CHEMICALS INC | 2011-08-03 | — | — | CN | disclosed |