Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | PDK1 | Q15118 | 2/20 | 0.41 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.40 |
| ▸ | VNN1 | O95497 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | SMO | Q99835 | 1/20 | 0.37 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL4786168 | 0.95 | TSHR (0.47) | TSHRGAAPDK1CXCR2VNN1 | |
| SCHEMBL4738973 | 0.90 | TSHR (0.44) | TSHRGAAPDK1CXCR2VNN1 | |
| SCHEMBL4737958 | 0.90 | TSHR (0.48) | TSHRGAAPDK1CXCR2VNN1 | |
| SCHEMBL4736736 | 0.89 | CDK9 (0.44) | TSHRGAAPDK1CXCR2VNN1 | |
| SCHEMBL4735150 | 0.89 | TSHR (0.51) | TSHRGAAPDK1CXCR2OPRM1 | |
| SCHEMBL4735235 | 0.84 | GAA (0.47) | TSHRGAAPDK1CXCR2OPRM1 | |
| SCHEMBL4733572 | 0.84 | TSHR (0.45) | TSHRGAAPDK1CXCR2OPRM1 | |
| SCHEMBL3064212 | 0.84 | OPRM1 (0.41) | TSHROPRM1OPRK1HSD17B10KMT2A | |
| SCHEMBL4736729 | 0.84 | TSHR (0.46) | TSHRGAAPDK1CXCR2OPRM1 | |
| SCHEMBL4736742 | 0.84 | GAA (0.46) | TSHRGAAPDK1CXCR2VNN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008073461-A2 | ION CHANNEL MODULATORS | WYETH (US) | 2008-06-19 | — | — | WO | claimed |