Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 2/20 | 0.39 |
| ▸ | CTSL | P07711 | 2/20 | 0.39 |
| ▸ | CTSB | P07858 | 2/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14515877 | 1.00 | CTSK (0.39) | CTSKCTSLCTSBCHRM5CYP1A2 | |
| SCHEMBL8094847 | 1.00 | CTSK (0.39) | CTSKCTSLCTSBCHRM5CYP1A2 | |
| Water SCHEMBL29188258 | 1.00 | CTSK (0.39) | CTSKCTSLCTSBCHRM5CYP1A2 | |
| SCHEMBL20491422 | 1.00 | CTSK (0.39) | CTSKCTSLCTSBCHRM5CYP1A2 | |
| SCHEMBL91247 | 1.00 | — | — | |
| SCHEMBL27838689 | 1.00 | CTSK (0.39) | CTSKCTSLCTSBCHRM5CYP1A2 | |
| SCHEMBL28456796 | 0.97 | CTSK (0.38) | CTSKCTSLCTSBCHRM5CYP1A2 | |
| Ammonia Solution, Strong SCHEMBL2292770 | 0.97 | CTSK (0.38) | CTSKCTSLCTSBCHRM5CYP1A2 | |
| SCHEMBL1437260 | 0.97 | — | — | |
| SCHEMBL938283 | 0.91 | — | — |
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-7569589-B2 | Potassium channel inhibitors | MERCK & CO., INC. (US) | 2009-08-04 | — | — | US | disclosed |