Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | MAN2A1 | Q16706 | 1/20 | 0.46 |
| ▸ | MAN1B1 | Q9UKM7 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 4/20 | 0.42 |
| ▸ | CA2 | P00918 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | MPO | P05164 | 3/20 | 0.41 |
| ▸ | CA9 | Q16790 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.40 |
| ▸ | TAS1R1 | Q7RTX1 | 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 | |
|---|---|---|---|---|
| SCHEMBL11977378 | 0.83 | POLB (0.53) | POLBMAPK1KDM4ETSHRCYP2D6 | |
| SCHEMBL11977399 | 0.81 | TSHR (0.50) | POLBMAPK1MAN2A1MAN1B1KDM4E | |
| SCHEMBL14046091 | 0.80 | KDM4E (0.62) | POLBMAPK1KDM4ETSHRCYP2D6 | |
| SCHEMBL14046092 | 0.77 | POLB (0.47) | POLBMAPK1KDM4ETSHRCYP2D6 | |
| SCHEMBL13881285 | 0.76 | POLB (0.46) | POLBMAPK1KDM4ETSHRCYP2D6 | |
| SCHEMBL9088007 | 0.76 | POLB (0.59) | POLBMAPK1TSHRCYP2D6HIF1A | |
| SCHEMBL19752695 | 0.75 | TSHR (0.55) | POLBMAPK1KDM4ETSHRCYP2D6 | |
| SCHEMBL12083340 | 0.75 | TSHR (0.55) | POLBMAPK1KDM4ETSHRCYP2D6 | |
| SCHEMBL31541563 | 0.75 | TSHR (0.55) | POLBMAPK1KDM4ETSHRCYP2D6 | |
| SCHEMBL22113497 | 0.75 | TSHR (0.55) | POLBMAPK1KDM4ETSHRCYP2D6 |
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-2010093327-A1 | TITANIUM COMPOUNDS AND PROCESS FOR CYANATION OF IMINES | AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) | 2010-08-19 | — | — | WO | disclosed |