Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 3/20 | 0.34 |
| ▸ | CA1 | P00915 | 3/20 | 0.34 |
| ▸ | CA2 | P00918 | 3/20 | 0.34 |
| ▸ | CA9 | Q16790 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19699301 | 0.93 | ALDH1A1 (0.36) | CYP1A2MAPK1CA12CA1CA2 | |
| SCHEMBL436610 | 0.92 | KDM4E (0.36) | KDM4ETSHRRECQLTDP1 | |
| SCHEMBL6381056 | 0.90 | KDM4E (0.35) | MAPK1KDM4ETSHRRECQLTDP1 | |
| SCHEMBL9641757 | 0.90 | CYP1A2 (0.39) | CYP1A2MAPK1CA12CA1CA2 | |
| SCHEMBL13168932 | 0.90 | CYP1A2 (0.39) | CYP1A2MAPK1CA12CA1CA2 | |
| SCHEMBL3826312 | 0.88 | TSHR (0.39) | CYP1A2KDM4ETSHRRECQLTDP1 | |
| SCHEMBL22739910 | 0.88 | TSHR (0.39) | CYP1A2KDM4ETSHRRECQLTDP1 | |
| SCHEMBL182026 | 0.88 | TSHR (0.39) | CYP1A2KDM4ETSHRRECQLTDP1 | |
| SCHEMBL9492420 | 0.87 | KDM4E (0.36) | KDM4ETSHRRECQLTDP1 | |
| SCHEMBL15015968 | 0.87 | CYP1A2 (0.43) | CYP1A2MAPK1CA12CA1CA2 |
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-5128408-A | Quaternized amino polyurethane- or polyurethaneurea-polysiloxanes treated with heparin | TOYO BOSEKI KABUSHIKI KAISHA (JP) | 1992-07-07 | — | — | US | disclosed |