Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRG2 | P18507 | 10/20 | 0.37 |
| ▸ | GABRB3 | P28472 | 10/20 | 0.37 |
| ▸ | GABRA5 | P31644 | 9/20 | 0.37 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.37 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | GABRP | O00591 | 1/20 | 0.37 |
| ▸ | GABRD | O14764 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.37 |
| ▸ | GABRE | P78334 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8030562 | 0.90 | GABRG2 (0.39) | GABRG2GABRB3GABRA5GABRA2GABRB2 | |
| SCHEMBL8028116 | 0.85 | GABRG2 (0.32) | GABRG2GABRB3GABRA3 | |
| SCHEMBL14996195 | 0.83 | GABRG2 (0.57) | GABRG2GABRB3GABRA5GABRA2GABRB2 | |
| SCHEMBL8019233 | 0.82 | GABRG2 (0.38) | GABRG2GABRB3GABRA5GABRA2GABRA3 | |
| SCHEMBL13002479 | 0.80 | KEAP1 (0.36) | MEN1ALDH1A1CYP1A2TSHRCYP2C19 | |
| SCHEMBL9269910 | 0.76 | GABRG2 (0.47) | GABRG2GABRB3GABRA5GABRA2GABRB2 | |
| SCHEMBL14996196 | 0.74 | GABRG2 (0.60) | GABRG2GABRB3GABRA5GABRA2GABRB2 | |
| Trifluoroacetic Acid SCHEMBL3760442 | 0.72 | CYP11B1 (0.34) | GABRG2GABRB3GABRA5ALDH1A1 | |
| SCHEMBL7636525 | 0.71 | GABRG2 (0.41) | GABRG2GABRB3GABRA5GABRA2GABRB2 | |
| SCHEMBL8032282 | 0.71 | GABRG2 (0.34) | GABRG2GABRB3GABRA5GABRA2GABRB2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2250157-B1 | NOVEL HETEROCYCLIC COMPOUNDS | PANACEA BIOTEC LTD (IN) | 2014-11-05 | — | — | EP | disclosed |
| US-8455479-B2 | Heterocyclic compounds | PANACEA BIOTEC LIMITED (IN) | 2013-06-04 | — | — | US | disclosed |
| WO-2009093269-A1 | NOVEL HETEROCYCLIC COMPOUNDS | PANACEA BIOTEC LIMITED (IN) | 2009-07-30 | — | — | WO | disclosed |