Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 7/20 | 0.39 |
| ▸ | CA4 | P22748 | 7/20 | 0.39 |
| ▸ | CA5A | P35218 | 7/20 | 0.39 |
| ▸ | CA7 | P43166 | 7/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 7/20 | 0.39 |
| ▸ | CA12 | O43570 | 6/20 | 0.39 |
| ▸ | CA1 | P00915 | 6/20 | 0.39 |
| ▸ | CA6 | P23280 | 4/20 | 0.39 |
| ▸ | CA9 | Q16790 | 4/20 | 0.39 |
| ▸ | CA13 | Q8N1Q1 | 4/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL146654 | 0.91 | TSHR (0.43) | TSHRPTPN1 | |
| SCHEMBL239974 | 0.84 | TSHR (0.55) | TSHRPTPN1CYP2D6ALDH1A1MAPK1 | |
| SCHEMBL12649848 | 0.84 | TSHR (0.55) | TSHRPTPN1CYP2D6ALDH1A1MAPK1 | |
| SCHEMBL15888786 | 0.84 | TSHR (0.55) | TSHRPTPN1CYP2D6ALDH1A1MAPK1 | |
| SCHEMBL14782693 | 0.83 | TSHR (0.63) | TSHRPTPN1CYP2D6ALDH1A1MAPK1 | |
| SCHEMBL14247838 | 0.83 | TSHR (0.63) | TSHRPTPN1CYP2D6ALDH1A1MAPK1 | |
| SCHEMBL3787332 | 0.83 | TSHR (0.63) | TSHRPTPN1CYP2D6ALDH1A1MAPK1 | |
| SCHEMBL12649999 | 0.81 | TSHR (0.64) | TSHRPTPN1CYP2D6LMNACA2 | |
| SCHEMBL222652 | 0.81 | TSHR (0.64) | TSHRPTPN1CYP2D6LMNACA2 | |
| SCHEMBL12601659 | 0.81 | TSHR (0.64) | TSHRPTPN1CYP2D6LMNACA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7943788-B2 | Including the antidiabetic, antiobesity sodium glucose transport inhibitor Canagliflozin (1-( beta -D-glucopyranosyl)-4-methyl-3-[5-(4-fluorophenyl)-2-thienylmethyl]benzene) | MITSUBISHI TANABE PHARMA CORPORATION (JP) | 2011-05-17 | — | — | US | disclosed |