Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | CA4 | P22748 | 1/20 | 0.43 |
| ▸ | CA6 | P23280 | 1/20 | 0.43 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.43 |
| ▸ | CA5A | P35218 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | SLC10A1 | Q14973 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.43 |
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.43 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.43 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.43 |
| ▸ | APP | P05067 | 8/20 | 0.42 |
| ▸ | HPGD | P15428 | 5/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2872971 | 0.81 | ALDH1A1 (0.46) | ALDH1A1CA12CA1CA2HTR1A | |
| SCHEMBL16577840 | 0.80 | ALDH1A1 (0.64) | ALDH1A1CA12CA1CA2HTR1A | |
| SCHEMBL16577841 | 0.79 | ALDH1A1 (0.52) | ALDH1A1CA12CA1CA2HTR1A | |
| SCHEMBL16577846 | 0.79 | APP (0.53) | ALDH1A1CA12CA1CA2HTR1A | |
| SCHEMBL16577837 | 0.78 | APP (0.49) | ALDH1A1CA12CA1CA2HTR1A | |
| SCHEMBL18993146 | 0.78 | ALDH1A1 (0.48) | ALDH1A1CA12CA1CA2HTR1A | |
| SCHEMBL230273 | 0.78 | CA12 (0.67) | ALDH1A1CA12CA1CA2HTR1A | |
| SCHEMBL28378526 | 0.77 | APP (0.65) | ALDH1A1CA12CA1CA2HTR1A | |
| SCHEMBL12391870 | 0.77 | ALDH1A1 (0.42) | ALDH1A1CA12CA1CA2HTR1A | |
| SCHEMBL22852468 | 0.76 | APP (0.69) | ALDH1A1CA12CA1CA2HTR1A |
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-9682928-B2 | Bumetanide analogs, compositions and methods of use | NEUROPRO THERAPEUTICS, INC. (US) | 2017-06-20 | — | — | US | disclosed |