Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSTP1 | P09211 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | LTA4H | P09960 | 4/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 3/20 | 0.41 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.41 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.38 |
| ▸ | BAX | Q07812 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | TGM2 | P21980 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL22169151 | 0.83 | ALDH1A1 (0.55) | CA9CA12CA2HPGDSMN1; SMN2 | |
| Hydrogen Sulfide SCHEMBL27719824 | 0.73 | GSTP1 (0.63) | GSTP1CA1CA2LTA4HTSHR | |
| SCHEMBL11751812 | 0.72 | GSTP1 (0.61) | GSTP1LTA4HTSHRNCOA1NCOA3 | |
| SCHEMBL8216660 | 0.72 | LTA4H (0.75) | LTA4HTSHRPGRHPGDSMN1; SMN2 | |
| SCHEMBL30051609 | 0.71 | CA12 (0.57) | GSTP1CA9CA12CA1CA2 | |
| SCHEMBL10622636 | 0.71 | TSHR (0.55) | CA9CA12CA1CA2LTA4H | |
| SCHEMBL21340447 | 0.70 | PGR (0.53) | CA9LTA4HTSHRPGRHPGD | |
| SCHEMBL16343963 | 0.70 | LTA4H (0.52) | GSTP1CA9LTA4HTSHRPGR | |
| SCHEMBL9730506 | 0.68 | GSTP1 (0.57) | GSTP1CA1CA2LTA4HTSHR | |
| Hydrochloric Acid SCHEMBL2868619 | 0.68 | PGR (0.52) | CA9LTA4HTSHRPGRHPGD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0710257-A1 | IMIDO TRANSITION METAL COMPLEX METATHESIS CATALYSTS | SHELL OIL CO (US) | 1996-05-08 | — | — | EP | disclosed |
| WO-1995003346-A1 | IMIDO TRANSITION METAL COMPLEX METATHESIS CATALYSTS | SHELL OIL COMPANY (US) | 1995-02-02 | — | — | WO | disclosed |