Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | CASP7 | P55210 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8596876 | 0.81 | ALDH1A1 (0.39) | EGFRCA12ALDH1A1KDM4ECA1 | |
| SCHEMBL8633335 | 0.79 | CA12 (0.33) | EGFRCA12ALDH1A1CA1CA2 | |
| SCHEMBL8598890 | 0.78 | TSHR (0.34) | TSHRMAPK1CYP19A1HIF1ACYP1A2 | |
| SCHEMBL8598258 | 0.78 | L3MBTL1 (0.47) | TSHRMAPK1HCAR3CYP1A2CA12 | |
| SCHEMBL8602043 | 0.78 | KDM4E (0.38) | TSHRMAPK1EGFRALDH1A1KDM4E | |
| SCHEMBL8567841 | 0.77 | CYP19A1 (0.57) | MAPK1CYP19A1CA12ALDH1A1KDM4E | |
| SCHEMBL8599937 | 0.77 | MAPT (0.48) | HCAR3EGFRCA12ALDH1A1CA1 | |
| SCHEMBL8562918 | 0.75 | CA12 (0.42) | MAPK1EGFRCYP1A2CA12ALDH1A1 | |
| SCHEMBL8597802 | 0.75 | ALDH1A1 (0.47) | TSHRMAPK1CYP19A1HCAR3HIF1A | |
| SCHEMBL8563003 | 0.74 | L3MBTL1 (0.45) | TSHRMAPK1EGFRCA12ALDH1A1 |
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-5648496-A | AMINATION | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1997-07-15 | — | — | US | disclosed |