Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 6/20 | 0.43 |
| ▸ | CA2 | P00918 | 6/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MPO | P05164 | 3/20 | 0.42 |
| ▸ | CA9 | Q16790 | 5/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11977371 | 0.87 | TSHR (0.55) | POLBMAPK1TSHRCYP2D6HIF1A | |
| SCHEMBL30532401 | 0.87 | TSHR (0.55) | POLBMAPK1TSHRCYP2D6HIF1A | |
| SCHEMBL13243155 | 0.82 | TSHR (0.50) | POLBMAPK1TSHRCYP2D6HIF1A | |
| SCHEMBL18706424 | 0.82 | TSHR (0.50) | POLBMAPK1TSHRCYP2D6HIF1A | |
| SCHEMBL18706425 | 0.82 | TSHR (0.50) | POLBMAPK1TSHRCYP2D6HIF1A | |
| SCHEMBL11977373 | 0.81 | POLB (0.49) | POLBMAPK1TSHRCYP2D6HIF1A | |
| SCHEMBL14046091 | 0.81 | KDM4E (0.62) | POLBMAPK1TSHRCYP2D6HIF1A | |
| SCHEMBL11977375 | 0.79 | POLB (0.51) | POLBMAPK1TSHRCYP2D6HIF1A | |
| SCHEMBL11977372 | 0.78 | MAPK1 (0.47) | POLBMAPK1TSHRCYP2D6HIF1A | |
| SCHEMBL13257899 | 0.77 | POLB (0.49) | POLBMAPK1TSHRCYP2D6HIF1A |
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-2008121076-A1 | TITANIUM COMPOUND AND PROCESS FOR ASYMMETRIC CYANATION OF IMINES | AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) | 2008-10-09 | — | — | WO | disclosed |