Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.51 |
| ▸ | GFER | P55789 | 1/20 | 0.51 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.46 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.45 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.42 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | FAAH | O00519 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28928289 | 0.89 | CYP2D6 (0.48) | CYP2C9CYP2C19CYP2D6GFERNR1H2 | |
| SCHEMBL2888693 | 0.84 | GABRA1 (0.41) | CYP2C9CYP2C19CYP2D6GABRA1GABRB2 | |
| SCHEMBL5318161 | 0.83 | L3MBTL1 (0.46) | CYP2C9CYP2C19CYP2D6GFERGABRA1 | |
| SCHEMBL14113377 | 0.81 | SLC6A4 (0.50) | CYP2C9CYP2D6GABRA1GABRB2LMNA | |
| SCHEMBL10914946 | 0.80 | NR1H2 (0.65) | CYP2C9CYP2C19CYP2D6GFERNR1H2 | |
| SCHEMBL30389926 | 0.80 | GABRA1 (0.48) | GABRA1GABRB2LMNAHPGDGABRG2 | |
| SCHEMBL4808650 | 0.80 | GABRA1 (0.48) | GABRA1GABRB2LMNAHPGDGABRG2 | |
| SCHEMBL4801714 | 0.79 | MMP2 (0.52) | CA1CA2DHFRMMP2MMP9 | |
| SCHEMBL2886389 | 0.75 | MAPT (0.51) | GFERLMNAHPGDDHFRMEN1 | |
| SCHEMBL153572 | 0.75 | NR1H2 (0.52) | CYP2C9CYP2C19CYP2D6GFERNR1H2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007064869-A2 | CATALYSTS FOR ARYL SULFIDE SYNTHESIS AND METHOD OF PRODUCING ARYL SULFIDES | YALE UNIVERSITY (US) | 2007-06-07 | — | — | WO | disclosed |
| WO-2007064869-A2 | CATALYSTS FOR ARYL SULFIDE SYNTHESIS AND METHOD OF PRODUCING ARYL SULFIDES | YALE UNIVERSITY (US) | 2007-06-07 | — | — | WO | disclosed |