Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 11/20 | 0.54 |
| ▸ | ERN1 | O75460 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2159827 | 0.85 | L3MBTL1 (0.45) | PTGS2ERN1CA12CA1CA2 | |
| SCHEMBL3071898 | 0.82 | ERN1 (0.56) | ERN1CA12CA1CA2CA9 | |
| SCHEMBL10898053 | 0.80 | ERN1 (0.50) | PTGS2ERN1CYP1A2MAPTCYP2C9 | |
| SCHEMBL28181882 | 0.79 | CA12 (0.68) | PTGS2CA12CA1CA2CA9 | |
| SCHEMBL9857364 | 0.79 | ERN1 (0.52) | ERN1CYP1A2MAPTCYP2C9CYP2C19 | |
| SCHEMBL28532809 | 0.78 | ERN1 (0.49) | ERN1CA12CA1CA2CA9 | |
| SCHEMBL29391032 | 0.78 | ERN1 (0.64) | ERN1CYP1A2MAPTCYP2C9CYP2C19 | |
| SCHEMBL808500 | 0.78 | ERN1 (0.64) | ERN1CYP1A2MAPTCYP2C9CYP2C19 | |
| SCHEMBL2159769 | 0.78 | PTGS2 (0.53) | PTGS2CA12CA1CA2CA9 | |
| SCHEMBL28324710 | 0.74 | ERN1 (0.55) | ERN1CA1CA2CA9CYP1A2 |
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-1692101-B1 | MERCAPTO-PHENYL-NAPHTHYL-METHANE DERIVATIVES AND PREPARATION THEREOF | COUNCIL SCIENT IND RES (IN) | 2011-07-06 | — | — | EP | claimed |