Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.37 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.37 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6005459 | 0.83 | TSHR (0.45) | TRPA1TSHRMAPTSLC1A3SLC1A2 | |
| SCHEMBL3742621 | 0.81 | TSHR (0.52) | TSHRCYP2C19CA1CA2CA7 | |
| SCHEMBL1571975 | 0.80 | TSHR (0.52) | TSHRMAPTSLC1A3SLC1A2SLC1A1 | |
| SCHEMBL12677779 | 0.78 | TSHR (0.48) | TSHRCYP2C19CA1CA2CA7 | |
| SCHEMBL10967301 | 0.76 | TSHR (0.45) | TSHRMAPTSLC1A3SLC1A2SLC1A1 | |
| SCHEMBL3275844 | 0.76 | TSHR (0.45) | TSHRMAPTSLC1A3SLC1A2SLC1A1 | |
| SCHEMBL27261214 | 0.76 | TSHR (0.45) | TSHRMAPTSLC1A3SLC1A2SLC1A1 | |
| SCHEMBL14285713 | 0.75 | CYP1A2 (0.52) | TSHRMAPTSLC1A3SLC1A2SLC1A1 | |
| SCHEMBL27032735 | 0.75 | TRPA1 (0.41) | TRPA1TSHRMAPTSLC1A3SLC1A2 | |
| SCHEMBL27133457 | 0.75 | TRPA1 (0.41) | TRPA1TSHRMAPTSLC1A3SLC1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5417959-A | Functionalized aza-crytand ligands for diagnostic imaging applications | MALLINCKRODT MEDICAL, INC. (US) | 1995-05-23 | — | — | US | disclosed |
| WO-1995010217-A2 | FUNCTIONALIZED AZA-CRYPTAND LIGANDS FOR IMAGING APPLICATIONS | MALLINCKRODT MEDICAL, INC. (US) | 1995-04-20 | — | — | WO | disclosed |