Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.51 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.51 |
| ▸ | HTR2C | P28335 | 3/20 | 0.50 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.44 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | IDH2 | P48735 | 1/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.42 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.42 |
| ▸ | GRK5 | P34947 | 1/20 | 0.42 |
| ▸ | CDK8 | P49336 | 1/20 | 0.42 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.42 |
| ▸ | KMO | O15229 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL21311648 | 1.00 | AKR1C3 (0.51) | AKR1C3AKR1C1HTR2CNOTUMPOLB | |
| SCHEMBL31154443 | 0.92 | AKR1C3 (0.62) | AKR1C3AKR1C1HTR2CNOTUMGRM2 | |
| SCHEMBL31154407 | 0.92 | AKR1C3 (0.62) | AKR1C3AKR1C1HTR2CNOTUMGRM2 | |
| SCHEMBL2532290 | 0.81 | HTR2C (0.72) | HTR2CDRD2HTR2AHTR2B | |
| SCHEMBL1072981 | 0.79 | AKR1C3 (0.79) | AKR1C3AKR1C1 | |
| SCHEMBL10177724 | 0.79 | AKR1C3 (0.79) | AKR1C3AKR1C1 | |
| SCHEMBL16457233 | 0.77 | HTR2C (0.72) | HTR2CDRD2KMOHTR2AHTR2B | |
| SCHEMBL21311688 | 0.77 | HTR2C (0.55) | HTR2CDRD2HTR2AHTR2B | |
| SCHEMBL20095988 | 0.77 | HTR2C (0.55) | HTR2CDRD2HTR2AHTR2B | |
| SCHEMBL21311601 | 0.77 | HTR2C (0.55) | HTR2CDRD2HTR2AHTR2B |
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-2019165290-A1 | PYRIDINE-SULFONAMIDE COMPOUNDS AND THEIR USE AGAINST PAIN AND RELATED CONDITIONS | GENENTECH, INC. (US) | 2019-08-29 | — | — | WO | disclosed |