Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNN4 | O15554 | 5/20 | 0.55 |
| ▸ | KIF11 | P52732 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.33 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.33 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL21839329 | 0.75 | KCNN4 (0.60) | KCNN4KIF11ALDH1A1TSHRMAPK1 | |
| SCHEMBL2363005 | 0.75 | KCNN4 (0.60) | KCNN4KIF11ALDH1A1TSHRMAPK1 | |
| Ammonia Solution, Strong SCHEMBL28866362 | 0.73 | KCNN4 (0.57) | KCNN4KIF11ALDH1A1TSHRMAPK1 | |
| Hydrogen Sulfide SCHEMBL28100574 | 0.73 | KCNN4 (0.57) | KCNN4KIF11ALDH1A1TSHRMAPK1 | |
| SCHEMBL4199607 | 0.72 | KCNN4 (0.44) | KCNN4ALDH1A1TSHRMAPK1TAAR1 | |
| SCHEMBL3228004 | 0.71 | KCNN4 (0.55) | KCNN4KIF11ALDH1A1TSHRMAPK1 | |
| SCHEMBL3232887 | 0.71 | KCNN4 (0.55) | KCNN4KIF11ALDH1A1TSHRMAPK1 | |
| SCHEMBL9439632 | 0.71 | KCNN4 (1.00) | KCNN4KIF11ALDH1A1TSHRMAPK1 | |
| SCHEMBL316124 | 0.71 | KCNN4 (0.55) | KCNN4KIF11ALDH1A1TSHRMAPK1 | |
| SCHEMBL11767238 | 0.71 | KCNN4 (0.55) | KCNN4KIF11ALDH1A1TSHRMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1991000858-A1 | PHARMACEUTICALLY ACTIVE COMPOUNDS | SCHERING CORPORATION (US) | 1991-01-24 | — | — | WO | disclosed |