Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.68 |
| ▸ | CA2 | P00918 | 2/20 | 0.68 |
| ▸ | CA9 | Q16790 | 2/20 | 0.68 |
| ▸ | CA1 | P00915 | 1/20 | 0.68 |
| ▸ | CA6 | P23280 | 1/20 | 0.68 |
| ▸ | PARP1 | P09874 | 1/20 | 0.59 |
| ▸ | FASN | P49327 | 1/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.55 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | CLK1 | P49759 | 1/20 | 0.50 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.50 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CA5A | P35218 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.48 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.48 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL4210189 | 1.00 | CA12 (0.68) | CA12CA2CA9CA1CA6 | |
| SCHEMBL4201619 | 1.00 | CA12 (0.68) | CA12CA2CA9CA1CA6 | |
| SCHEMBL10918700 | 0.88 | CA12 (0.59) | CA12CA2CA9CA1CA6 | |
| SCHEMBL9469152 | 0.84 | PARP1 (0.53) | CA12CA2CA9CA1CA6 | |
| SCHEMBL9469158 | 0.84 | PARP1 (0.53) | CA12CA2CA9CA1CA6 | |
| SCHEMBL9187064 | 0.82 | CA12 (0.68) | CA12CA2CA9CA1CA6 | |
| SCHEMBL11263234 | 0.82 | CA12 (0.52) | CA12CA2CA9CA1CA6 | |
| 3-Hydroxybenzoic Acid SCHEMBL8679140 | 0.81 | CA12 (1.00) | CA12CA2CA9CA1CA6 | |
| 3-Hydroxybenzoic Acid SCHEMBL29378849 | 0.81 | CA12 (1.00) | CA12CA2CA9CA1CA6 | |
| 3-Hydroxybenzoic Acid SCHEMBL9153881 | 0.81 | CA12 (1.00) | CA12CA2CA9CA1CA6 |
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 |
|---|---|---|---|---|---|---|---|
| US-7491840-B2 | Compound and composition containing the same | MITSUI CHEMICALS, INC. (JP) | 2009-02-17 | — | — | US | disclosed |