Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH2 | P25021 | 1/20 | 0.45 |
| ▸ | HRH1 | P35367 | 1/20 | 0.45 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.40 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | GABRP | O00591 | 1/20 | 0.39 |
| ▸ | GABRD | O14764 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.39 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.39 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.39 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1828357 | 0.84 | GRM2 (0.42) | HRH2HRH1GRM2GABRA1GABRG2 | |
| SCHEMBL244137 | 0.83 | PDE4B (0.41) | GABRPGABRDCYP1A2CYP2D6CYP2C9 | |
| SCHEMBL1828937 | 0.83 | HRH2 (0.40) | HRH2HRH1MMP2FFAR1 | |
| SCHEMBL1829979 | 0.80 | HRH2 (0.40) | HRH2HRH1GRM2MAPK14HTR1A | |
| SCHEMBL1829774 | 0.79 | HRH2 (0.41) | HRH2HRH1GRM2MAPK14KEAP1 | |
| SCHEMBL1829683 | 0.78 | HRH2 (0.44) | HRH2HRH1GRM2CYP2C19HSD17B10 | |
| SCHEMBL245423 | 0.77 | CASP3 (0.45) | CASP3SENP8SENP7SENP6MAPKAPK2 | |
| SCHEMBL1828903 | 0.77 | GRM2 (0.38) | HRH2HRH1GRM2MAPK14FNTA | |
| SCHEMBL1903906 | 0.76 | HRH2 (0.37) | HRH2HRH1GRM2FNTAFNTB | |
| SCHEMBL1828289 | 0.76 | ADH5 (0.51) | CYP2C19 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2315590-A1 | PYRROLE INHIBITORS OF S-NITROSOGLUTATHIONE REDUCTASE | N30 Pharmaceuticals, LLC (US) | 2011-05-04 | — | — | EP | disclosed |
| WO-2010019909-A1 | PYRROLE INHIBITORS OF S-NITROSOGLUTATHIONE REDUCTASE | N30 PHARMACEUTICALS, LLC (US) | 2010-02-18 | — | — | WO | disclosed |