Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 3/20 | 0.66 |
| ▸ | HTR2A | P28223 | 2/20 | 0.66 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.66 |
| ▸ | CHEK2 | O96017 | 7/20 | 0.52 |
| ▸ | ESRRA | P11474 | 1/20 | 0.48 |
| ▸ | KMO | O15229 | 1/20 | 0.48 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.48 |
| ▸ | PARP15 | Q460N3 | 2/20 | 0.47 |
| ▸ | PARP14 | Q460N5 | 2/20 | 0.47 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.47 |
| ▸ | TNKS | O95271 | 1/20 | 0.47 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.47 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | F2 | P00734 | 1/20 | 0.46 |
| ▸ | F10 | P00742 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL16319568 | 0.87 | SLC6A4 (0.65) | SLC6A4HTR2AKCNH2CHEK2KMO | |
| SCHEMBL364754 | 0.85 | SLC6A4 (0.64) | SLC6A4HTR2AKCNH2CHEK2PARP10 | |
| SCHEMBL10252664 | 0.84 | SIRT2 (0.53) | SLC6A4HTR2AKCNH2CHEK2ESRRA | |
| SCHEMBL27486876 | 0.83 | PARP10 (0.59) | SLC6A4HTR2AKCNH2CHEK2PARP15 | |
| SCHEMBL367843 | 0.81 | BCAT2 (0.65) | SLC6A4HTR2AKCNH2CHEK2KMO | |
| SCHEMBL28866121 | 0.81 | BCAT2 (0.65) | SLC6A4HTR2AKCNH2CHEK2KMO | |
| SCHEMBL3701320 | 0.81 | PARP10 (0.65) | SLC6A4HTR2AKCNH2CHEK2ESRRA | |
| SCHEMBL11355202 | 0.79 | SLC6A2 (0.58) | SLC6A4PARP15PARP14PARP10TNKS | |
| Hydrochloric Acid SCHEMBL4372370 | 0.79 | BCAT2 (0.62) | SLC6A4HTR2AKCNH2CHEK2KMO | |
| SCHEMBL3699757 | 0.77 | CHEK2 (0.59) | SLC6A4HTR2AKCNH2CHEK2ESRRA |
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-2593427-B1 | SULFONAMIDE DERIVATIVES AS NAV1.7 INHIBITORS FOR THE TREATMENT OF PAIN | PFIZER LTD (GB) | 2014-12-24 | — | — | EP | disclosed |