Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.32 |
| ▸ | CHRNB3 | Q05901 | 2/20 | 0.32 |
| ▸ | CHRNA6 | Q15825 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL551635 | 1.00 | CYP2C9 (0.37) | CYP2C9TSHRCYP2C19TDP1MAPK1 | |
| SCHEMBL550147 | 1.00 | CYP2C9 (0.37) | CYP2C9TSHRCYP2C19TDP1MAPK1 | |
| SCHEMBL550510 | 0.96 | CYP2C9 (0.39) | CYP2C9TSHRCYP2C19TDP1MAPK1 | |
| SCHEMBL21965258 | 0.96 | MAPK1 (0.38) | CYP2C9TSHRCYP2C19TDP1MAPK1 | |
| Hydrochloric Acid SCHEMBL1819609 | 0.92 | CYP2C9 (0.37) | CYP2C9TSHRCYP2C19TDP1MAPK1 | |
| SCHEMBL16878579 | 0.92 | MAPK1 (0.36) | CYP2C9TSHRCYP2C19TDP1MAPK1 | |
| SCHEMBL550429 | 0.92 | — | — | |
| SCHEMBL14545648 | 0.92 | — | — | |
| SCHEMBL9464271 | 0.92 | ALDH1A1 (0.36) | CYP2C9TSHRCYP2C19TDP1MAPK1 | |
| SCHEMBL2290579 | 0.88 | — | — |
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-1998043637-A9 | PEROXYNITRITE DECOMPOSITION CATALYST | MONSANTO CO (US) | 2001-05-03 | — | — | WO | claimed |