Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRG2 | P18507 | 13/20 | 0.41 |
| ▸ | GABRB3 | P28472 | 13/20 | 0.41 |
| ▸ | GABRA3 | P34903 | 13/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 12/20 | 0.41 |
| ▸ | GABRA2 | P47869 | 9/20 | 0.41 |
| ▸ | GABRA5 | P31644 | 6/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | TNNI3 | P19429 | 1/20 | 0.34 |
| ▸ | CRHBP | P24387 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | TNNT2 | P45379 | 1/20 | 0.34 |
| ▸ | CASP7 | P55210 | 1/20 | 0.34 |
| ▸ | TNNC1 | P63316 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2657906 | 0.83 | GABRA1 (0.45) | GABRG2GABRB3GABRA3GABRA1GABRA2 | |
| SCHEMBL2659605 | 0.82 | GABRG2 (0.42) | GABRG2GABRB3GABRA3GABRA1GABRA2 | |
| SCHEMBL7000853 | 0.79 | GABRG2 (0.48) | GABRG2GABRB3GABRA3GABRA1GABRA2 | |
| SCHEMBL7000551 | 0.78 | GABRA1 (0.38) | GABRG2GABRB3GABRA3GABRA1GABRA2 | |
| SCHEMBL7000823 | 0.76 | GABRA1 (0.43) | GABRG2GABRB3GABRA3GABRA1GABRA2 | |
| SCHEMBL2659167 | 0.72 | GABRG2 (0.43) | GABRG2GABRB3GABRA3GABRA1GABRA2 | |
| SCHEMBL2659165 | 0.71 | GABRG2 (0.53) | GABRG2GABRB3GABRA3GABRA1GABRA2 | |
| SCHEMBL6996337 | 0.71 | GABRG2 (0.46) | GABRG2GABRB3GABRA3GABRA1GABRA2 | |
| SCHEMBL6998651 | 0.70 | GABRG2 (0.42) | GABRG2GABRB3GABRA3GABRA1GABRA2 | |
| SCHEMBL2657377 | 0.69 | CASP1 (0.38) | GABRG2GABRB3GABRA3GABRA1GABRA2 |
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-1212324-B1 | IMIDAZO-TRIAZINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS | MERCK SHARP & DOHME (GB) | 2003-10-29 | — | — | EP | disclosed |
| US-6608062-B1 | Ligands for gamma-aminobutyric acid receptors; treatment and/or prevention of central nervous system disorders, including anxiety | MERCK SHARP & DOHME LTD. | 2003-08-19 | — | — | US | disclosed |