Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.36 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Triaziquone SCHEMBL8763013 | 0.92 | SMN1; SMN2 (0.38) | TSHRCA1CA2USP2MAPK1 | |
| Trifluoroacetic Acid SCHEMBL8763902 | 0.81 | CYP2C9 (0.49) | TSHRCYP2C9CA12CA1CA2 | |
| Triaziquone SCHEMBL8763030 | 0.79 | DPP4 (0.31) | KDM4E | |
| SCHEMBL7749748 | 0.72 | CYP2C9 (0.57) | TSHRCYP2C9CA12CA1CA2 | |
| Triaziquone SCHEMBL1462397 | 0.72 | DNMT1 (0.38) | TSHRHTTMEN1MAPK1KMT2A | |
| SCHEMBL7749751 | 0.72 | CYP2C9 (0.57) | TSHRCYP2C9CA12CA1CA2 | |
| Hydrochloric Acid SCHEMBL8368674 | 0.71 | CYP2C9 (0.56) | TSHRCYP2C9CA12CA1CA2 | |
| Triaziquone SCHEMBL15269829 | 0.71 | DNMT1 (0.37) | TSHRHTTMAPK1CYP3A4 | |
| Hydrochloric Acid SCHEMBL8368672 | 0.71 | CYP2C9 (0.56) | TSHRCYP2C9CA12CA1CA2 | |
| Trifluoroacetic Acid SCHEMBL8763021 | 0.70 | SMN1; SMN2 (0.47) | TSHRCA1CA2ALDH1A1USP2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0783517-A2 | THIOL-FREE INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE | MERCK & CO. INC. (US) | 1997-07-16 | — | — | EP | disclosed |