Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 7/20 | 0.43 |
| ▸ | DPP4 | P27487 | 2/20 | 0.36 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.36 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.36 |
| ▸ | GABRP | O00591 | 1/20 | 0.34 |
| ▸ | GABRD | O14764 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.34 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.34 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.34 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.34 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.34 |
| ▸ | GABRE | P78334 | 1/20 | 0.34 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.34 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.34 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.34 |
| ▸ | GABRQ | Q9UN88 | 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 | |
|---|---|---|---|---|
| SCHEMBL11203864 | 0.84 | HCAR2 (0.44) | HCAR2GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL11210298 | 0.79 | HCAR2 (0.41) | HCAR2GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL12486045 | 0.74 | HCAR2 (0.42) | HCAR2TTRP2RX7NPC1RAB9A | |
| SCHEMBL27737815 | 0.72 | HCAR2 (0.54) | HCAR2DPP4GABRPGABRDGABRA1 | |
| SCHEMBL2077234 | 0.72 | HCAR2 (0.52) | HCAR2GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL9218944 | 0.69 | HCAR2 (0.43) | HCAR2DPP4DPP8DPP9TTR | |
| SCHEMBL3804253 | 0.67 | GAA (0.40) | HCAR2GABRPGABRDGABRA1GABRB1 | |
| Hydrochloric Acid SCHEMBL5287806 | 0.66 | P2RX7 (0.36) | HCAR2TTRP2RX7 | |
| SCHEMBL3402262 | 0.66 | P2RX7 (0.48) | HCAR2DPP4DPP9TTRP2RX7 | |
| SCHEMBL27737480 | 0.65 | HCAR2 (0.49) | HCAR2GABRPGABRDGABRA1GABRB1 |
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-1781661-A2 | VASOPRESSIN V1A ANTAGONISTS | Ferring B.V. (NL) | 2007-05-09 | — | — | EP | disclosed |
| WO-2006021213-A2 | VASOPRESSIN V1A ANTAGONISTS | FERRING B.V. (NL) | 2006-03-02 | — | — | WO | disclosed |