Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 2/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.41 |
| ▸ | GABRP | O00591 | 2/20 | 0.35 |
| ▸ | GABRD | O14764 | 2/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.35 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.35 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.35 |
| ▸ | GABRE | P78334 | 2/20 | 0.35 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.35 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.35 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.35 |
| ▸ | GABRQ | Q9UN88 | 2/20 | 0.35 |
| ▸ | SHBG | P04278 | 1/20 | 0.35 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL26304098 | 1.00 | GRIN1 (0.41) | GRIN1GRIN2BGABRPGABRDGABRA1 | |
| SCHEMBL133513 | 0.81 | GRIN1 (0.60) | GRIN1GRIN2BSHBGNR1I3 | |
| SCHEMBL6812629 | 0.81 | GRIN1 (0.60) | GRIN1GRIN2BSHBGNR1I3 | |
| SCHEMBL22018389 | 0.81 | GRIN1 (0.60) | GRIN1GRIN2BSHBGNR1I3 | |
| SCHEMBL13007746 | 0.81 | GRIN1 (0.60) | GRIN1GRIN2BSHBGNR1I3 | |
| SCHEMBL4640991 | 0.79 | GABRP (0.36) | GRIN1GRIN2BGABRPGABRDGABRA1 | |
| SCHEMBL15963546 | 0.76 | SHBG (0.45) | GRIN1GRIN2BSHBG | |
| SCHEMBL17340849 | 0.76 | GRIN1 (0.42) | GRIN1GRIN2BSHBG | |
| SCHEMBL15963554 | 0.76 | SHBG (0.45) | GRIN1GRIN2BSHBG | |
| SCHEMBL15963427 | 0.76 | SHBG (0.45) | GRIN1GRIN2BSHBG |
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-2039702-A2 | Prodrugs erbeta-selective substances, method for their production and pharmaceutical compounds containing these compositions | Bayer Schering Pharma Aktiengesellschaft (DE) | 2009-03-25 | — | — | EP | claimed |