Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.61 |
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 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 | |
|---|---|---|---|---|
| SCHEMBL7458451 | 0.81 | ALDH1A1 (0.51) | THRBPKMALDH1A1ALOX15GAA | |
| SCHEMBL30091366 | 0.80 | ALDH1A1 (0.48) | PKMALDH1A1ALOX15GAATSHR | |
| SCHEMBL1846645 | 0.80 | ALDH1A1 (0.48) | PKMALDH1A1ALOX15GAATSHR | |
| SCHEMBL6058401 | 0.79 | ALDH1A1 (0.61) | PKMALDH1A1GAALMNA | |
| SCHEMBL21264043 | 0.78 | THRB (0.39) | THRBPKMALDH1A1HSD17B10TSHR | |
| SCHEMBL6230363 | 0.77 | THRB (0.67) | THRBPKMALDH1A1GAALMNA | |
| SCHEMBL6059014 | 0.77 | GAA (0.51) | THRBPKMALDH1A1ALOX15HSD17B10 | |
| SCHEMBL14341834 | 0.76 | THRB (1.00) | THRBPKMGAALMNAP2RX7 | |
| SCHEMBL23220249 | 0.76 | THRB (0.63) | THRBALDH1A1LMNA | |
| SCHEMBL2841738 | 0.76 | THRB (0.63) | THRBALDH1A1LMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-RE39744-E1 | Adamantane derivatives and process for producing them | DAICEL CHEMICAL INDUSTRIES, LTD. (JP) | 2007-07-24 | — | — | US | disclosed |
| US-6392104-B1 | CHEMICAL INTERMEDIATES FOR DRUGS, AGRICULTURE | DAICEL CHEMICAL INDUSTRIES, LTD. (JP) | 2002-05-21 | — | — | US | disclosed |
| EP-0927711-A1 | ADAMANTANE DERIVATIVES AND PROCESS FOR PRODUCING THEM | Daicel Chemical Industries, Ltd. (JP) | 1999-07-07 | — | — | EP | disclosed |