Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CISD1 | Q9NZ45 | 9/20 | 0.65 |
| ▸ | CA12 | O43570 | 2/20 | 0.65 |
| ▸ | CA1 | P00915 | 2/20 | 0.65 |
| ▸ | CA2 | P00918 | 2/20 | 0.65 |
| ▸ | CA6 | P23280 | 2/20 | 0.65 |
| ▸ | CA5A | P35218 | 2/20 | 0.65 |
| ▸ | CA7 | P43166 | 2/20 | 0.65 |
| ▸ | CA9 | Q16790 | 2/20 | 0.65 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.65 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.65 |
| ▸ | HTR1A | P08908 | 1/20 | 0.65 |
| ▸ | CA4 | P22748 | 1/20 | 0.65 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.65 |
| ▸ | SLC10A1 | Q14973 | 1/20 | 0.65 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.65 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.65 |
| ▸ | APP | P05067 | 9/20 | 0.58 |
| ▸ | AQP1 | P29972 | 1/20 | 0.54 |
| ▸ | CA3 | P07451 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL21423525 | 0.91 | CA12 (0.69) | CISD1CA12CA1CA2CA6 | |
| SCHEMBL230351 | 0.91 | CISD1 (0.69) | CISD1CA12CA1CA2CA6 | |
| SCHEMBL12418670 | 0.90 | CISD1 (0.70) | CISD1CA12CA1CA2CA6 | |
| SCHEMBL2956412 | 0.90 | CISD1 (0.65) | CISD1CA12CA1CA2CA6 | |
| SCHEMBL230706 | 0.89 | CISD1 (0.68) | CISD1CA12CA1CA2CA6 | |
| SCHEMBL230662 | 0.89 | CISD1 (0.68) | CISD1CA12CA1CA2CA6 | |
| SCHEMBL12418612 | 0.88 | CA12 (0.70) | CISD1CA12CA1CA2CA6 | |
| SCHEMBL2960877 | 0.87 | CA12 (0.71) | CISD1CA12CA1CA2CA6 | |
| SCHEMBL229243 | 0.87 | CA1 (0.74) | CISD1CA12CA1CA2CA6 | |
| SCHEMBL2957873 | 0.87 | CA12 (0.66) | CISD1CA12CA1CA2CA6 |
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-1951702-A2 | DIURETIC-LIKE COMPOUND ANALOGS USEFUL FOR REGULATION OF CENTRAL NERVOUS SYSTEM DISORDERS | NeuroTherapeutics Pharma, Inc. (US) | 2008-08-06 | — | — | EP | disclosed |
| WO-2007047447-A2 | DIURETIC-LIKE COMPOUND ANALOGS USEFUL FOR REGULATION OF CENTRAL NERVOUS SYSTEM DISORDERS | NEUROTHERAPEUTICS PHARMA, INC. (US) | 2007-04-26 | — | — | WO | disclosed |