Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 10/20 | 0.51 |
| ▸ | CA2 | P00918 | 10/20 | 0.51 |
| ▸ | CA9 | Q16790 | 8/20 | 0.51 |
| ▸ | CA12 | O43570 | 5/20 | 0.51 |
| ▸ | CA6 | P23280 | 3/20 | 0.48 |
| ▸ | CA5A | P35218 | 3/20 | 0.48 |
| ▸ | CA4 | P22748 | 2/20 | 0.48 |
| ▸ | CA7 | P43166 | 2/20 | 0.48 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.48 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.45 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.43 |
| ▸ | PTGES2 | Q9H7Z7 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL30593603 | 0.98 | CA1 (0.53) | CA1CA2CA9CA12CA6 | |
| SCHEMBL1106519 | 0.98 | CA1 (0.53) | CA1CA2CA9CA12CA6 | |
| Hydrochloric Acid SCHEMBL28262186 | 0.96 | CA1 (0.51) | CA1CA2CA9CA12CA6 | |
| Potassium SCHEMBL9493381 | 0.96 | CA1 (0.51) | CA1CA2CA9CA12CA6 | |
| SCHEMBL731096 | 0.83 | CA2 (0.48) | CA1CA2CA9CA12CA6 | |
| SCHEMBL28360228 | 0.82 | CA2 (0.52) | CA1CA2CA9CA12CA6 | |
| SCHEMBL10641489 | 0.82 | CA2 (0.47) | CA1CA2CA9CA12CA6 | |
| SCHEMBL8428528 | 0.82 | CA2 (0.47) | CA1CA2CA9CA12CA6 | |
| SCHEMBL3284628 | 0.82 | HTR2A (0.48) | CA1CA2CA9CA12CA6 | |
| SCHEMBL9379437 | 0.80 | HSD11B1 (0.54) | CA1CA2CA9CA12GABRA1 |
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-5270313-A | Treatment of circulatory disorders | HOFFMANN-LA ROCHE INC. (US) | 1993-12-14 | — | — | US | disclosed |