Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 5/20 | 0.43 |
| ▸ | GABRG2 | P18507 | 5/20 | 0.43 |
| ▸ | GABRB3 | P28472 | 5/20 | 0.43 |
| ▸ | GABRA2 | P47869 | 3/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.41 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.41 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.41 |
| ▸ | PDGFRB | P09619 | 4/20 | 0.40 |
| ▸ | PDGFRA | P16234 | 4/20 | 0.40 |
| ▸ | FYN | P06241 | 4/20 | 0.40 |
| ▸ | GABRA5 | P31644 | 4/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 4/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6199891 | 0.84 | GABRA1 (0.47) | GABRA1GABRG2GABRB3GABRA2FYN | |
| SCHEMBL6200896 | 0.69 | GABRA1 (0.54) | GABRA1GABRG2GABRB3GABRA2FYN | |
| SCHEMBL4350314 | 0.69 | CYP2A6 (0.68) | CYP2A6CYP2B6CYP2E1PDGFRBPDGFRA | |
| SCHEMBL835270 | 0.67 | FYN (0.47) | PDGFRBPDGFRAFYN | |
| SCHEMBL6201408 | 0.67 | GABRA1 (0.46) | GABRA1GABRG2GABRB3GABRA2GABRA5 | |
| SCHEMBL14014085 | 0.67 | KDM4E (0.55) | GABRA1GABRG2GABRB3GABRA2 | |
| SCHEMBL6198098 | 0.67 | GABRA1 (0.46) | GABRA1GABRG2GABRB3GABRA2CYP2A6 | |
| SCHEMBL6203180 | 0.66 | GABRA1 (0.48) | GABRA1GABRG2GABRB3GABRA2FYN | |
| SCHEMBL6202421 | 0.66 | GABRG2 (0.60) | GABRA1GABRG2GABRB3GABRA2FYN | |
| SCHEMBL30172705 | 0.65 | CYP2A6 (0.56) | CYP2A6CYP2B6CYP2E1PDGFRBPDGFRA |
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-1343788-B1 | IMIDAZO-TRIAZINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS | MERCK SHARP & DOHME (GB) | 2005-11-23 | — | — | EP | claimed |