Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNK2 | O95069 | 1/20 | 0.37 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | KCNB1 | Q14721 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | APP | P05067 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.34 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.34 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | DRD1 | P21728 | 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 | |
|---|---|---|---|---|
| SCHEMBL20117519 | 0.82 | ALDH1A1 (0.49) | ALDH1A1DRD3KDM4ELMNA | |
| SCHEMBL14350620 | 0.80 | IDO1 (0.44) | MEN1KMT2AALDH1A1ADRB2ADRB1 | |
| SCHEMBL6280812 | 0.80 | HIF1A (0.54) | ALDH1A1TSHRHIF1AADRB2ADRB1 | |
| SCHEMBL4537117 | 0.80 | IDO1 (0.44) | MEN1KMT2AALDH1A1ADRB2ADRB1 | |
| SCHEMBL14262065 | 0.80 | USP1 (0.43) | ROCK2ALDH1A1LMNA | |
| SCHEMBL24453717 | 0.80 | USP1 (0.43) | ROCK2ALDH1A1LMNA | |
| SCHEMBL16096523 | 0.80 | HIF1A (0.54) | ALDH1A1TSHRHIF1AADRB2ADRB1 | |
| SCHEMBL6632539 | 0.79 | CYP3A4 (0.43) | KCNH2ROCK2ALDH1A1TSHRHIF1A | |
| SCHEMBL4049006 | 0.79 | SLC6A2 (0.43) | KCNH2ALDH1A1SLC6A3GAA | |
| Hydrochloric Acid SCHEMBL4739557 | 0.79 | LMNA (0.56) | MEN1KMT2AALDH1A1TSHRHIF1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2349990-B1 | ARYL-PHENYL-SULFONAMIDE-PHENYLENE COMPOUNDS AND THEIR USE | PIMCO 2664 LTD (GB) | 2018-05-02 | — | — | EP | disclosed |