Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR3 | Q99500 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 8/20 | 0.36 |
| ▸ | CA2 | P00918 | 8/20 | 0.36 |
| ▸ | CA9 | Q16790 | 7/20 | 0.36 |
| ▸ | CA12 | O43570 | 3/20 | 0.36 |
| ▸ | CA7 | P43166 | 3/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.36 |
| ▸ | CA3 | P07451 | 2/20 | 0.36 |
| ▸ | CA4 | P22748 | 2/20 | 0.36 |
| ▸ | CA6 | P23280 | 2/20 | 0.36 |
| ▸ | CA5A | P35218 | 2/20 | 0.36 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 2/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL198760 | 0.93 | CA1 (0.41) | CA1CA2CA9CA12CA7 | |
| SCHEMBL198864 | 0.93 | CA1 (0.41) | CA1CA2CA9CA12CA7 | |
| SCHEMBL3389667 | 0.89 | L3MBTL1 (0.38) | ALDH1A1TDP1L3MBTL1HPGDTSHR | |
| SCHEMBL196527 | 0.88 | L3MBTL1 (0.42) | CA1CA2CA9CA12CA7 | |
| SCHEMBL197086 | 0.82 | CA1 (0.41) | CA1CA2CA9CA12CA7 | |
| SCHEMBL196809 | 0.82 | CA1 (0.41) | CA1CA2CA9CA12CA7 | |
| SCHEMBL196493 | 0.82 | L3MBTL1 (0.42) | ALDH1A1TDP1L3MBTL1RECQLTSHR | |
| SCHEMBL28734121 | 0.77 | CA1 (0.39) | CA1CA2CA9CA12CA7 | |
| SCHEMBL811604 | 0.77 | TSHR (0.43) | ALDH1A1L3MBTL1RECQLHPGDTSHR | |
| SCHEMBL197409 | 0.77 | CA1 (0.41) | S1PR3CA1CA2CA9CA12 |
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-2233459-A1 | METHOD FOR PRODUCING CONJUGATED AROMATIC COMPOUND | Sumitomo Chemical Company, Limited (JP) | 2010-09-29 | — | — | EP | disclosed |