Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ORAI1 | Q96D31 | 3/20 | 0.46 |
| ▸ | ORAI2 | Q96SN7 | 3/20 | 0.46 |
| ▸ | ORAI3 | Q9BRQ5 | 3/20 | 0.46 |
| ▸ | TRPV6 | Q9H1D0 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.35 |
| ▸ | PCSK9 | Q8NBP7 | 2/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | CA6 | P23280 | 1/20 | 0.35 |
| ▸ | CA5A | P35218 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | TRPM2 | O94759 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL117263 | 0.91 | ALDH1A1 (0.45) | ORAI1ORAI2ORAI3TRPV6TSHR | |
| Benzene SCHEMBL10445518 | 0.91 | ALDH1A1 (0.45) | ORAI1ORAI2ORAI3TRPV6TSHR | |
| SCHEMBL1138735 | 0.87 | ENPP2 (0.46) | ORAI1ORAI2ORAI3TRPV6ALDH1A1 | |
| SCHEMBL4832666 | 0.84 | CYP2D6 (0.36) | ORAI1ORAI2ORAI3TRPV6TSHR | |
| Fluorobenzene SCHEMBL10445356 | 0.82 | ENPP2 (0.40) | ORAI1ORAI2ORAI3TRPV6TSHR | |
| Toluene SCHEMBL9334989 | 0.82 | TSHR (0.39) | ORAI1ORAI2ORAI3TRPV6TSHR | |
| SCHEMBL2782096 | 0.80 | ALDH1A1 (0.34) | TSHRALDH1A1RECQLENPP2MAPK1 | |
| SCHEMBL20491586 | 0.80 | MGLL (0.50) | TSHRALDH1A1RECQLGAA | |
| SCHEMBL1491911 | 0.79 | PCSK9 (0.41) | ORAI1ORAI2ORAI3TRPV6TSHR | |
| Trifluoromethylbenzene SCHEMBL10445339 | 0.78 | TRPV6 (0.50) | ORAI1ORAI2ORAI3TRPV6TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-0379300-A2 | Separation of 1,2-dihydroxycyclohexa-3,5-diene compounds | ZENECA LIMITED (GB) | 1990-07-25 | — | — | EP | disclosed |