Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | NAAA | Q02083 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 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 | |
|---|---|---|---|---|
| SCHEMBL15899223 | 0.86 | CA1 (0.46) | CA1TSHRCA2CA7CA9 | |
| SCHEMBL18933241 | 0.78 | TSHR (0.47) | CA1TSHRCA2CA7CA9 | |
| SCHEMBL15899225 | 0.76 | CA1 (0.46) | CA1TSHRCA2CA7CA9 | |
| SCHEMBL27363085 | 0.76 | TSHR (0.48) | CA1TSHRCA2CA7CA9 | |
| SCHEMBL9233739 | 0.76 | KDM4E (0.50) | CA1TSHRCA2CA7CA9 | |
| SCHEMBL6886009 | 0.75 | TSHR (0.56) | CA1TSHRKDM4EPOLBNAAA | |
| SCHEMBL16391273 | 0.74 | TSHR (0.47) | TSHRKDM4EPOLBHTTSMN1; SMN2 | |
| SCHEMBL1902544 | 0.74 | KDM4E (0.49) | CA1TSHRKDM4EPOLBL3MBTL1 | |
| SCHEMBL1902542 | 0.74 | KDM4E (0.49) | CA1TSHRKDM4EPOLBL3MBTL1 | |
| SCHEMBL7399740 | 0.73 | TSHR (0.65) | CA1TSHRCA2CA7CA9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1099478-B1 | Intercalation compound | TONEN SEKIYUKAGAKU KK (JP) | 2005-12-14 | — | — | EP | disclosed |
| EP-1502647-A2 | Process for the preparation of an intercalation compound | Tonen Chemical Corporation (JP) | 2005-02-02 | — | — | EP | disclosed |
| EP-1099478-A2 | Intercalation compound and a vanadium phosphorus mixed oxide and a process for the preparation thereof | Tonen Chemical Corporation (JP) | 2001-05-16 | — | — | EP | disclosed |