Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | PTGER3 | P43115 | 2/20 | 0.42 |
| ▸ | GABRP | O00591 | 2/20 | 0.40 |
| ▸ | GABRD | O14764 | 2/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.40 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.40 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.40 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.40 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.40 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.40 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.40 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.40 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.40 |
| ▸ | GABRE | P78334 | 2/20 | 0.40 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.40 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.40 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.40 |
| ▸ | GABRQ | Q9UN88 | 2/20 | 0.40 |
| ▸ | SPR | P35270 | 1/20 | 0.40 |
| ▸ | TNKS | O95271 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29978023 | 1.00 | ADORA3 (0.43) | ADORA3PTGER3GABRPGABRDGABRA1 | |
| SCHEMBL23112528 | 0.89 | PTGER3 (0.46) | PTGER3SPRTNKSPARP1TNKS2 | |
| SCHEMBL29977665 | 0.89 | PTGER3 (0.46) | PTGER3SPRTNKSPARP1TNKS2 | |
| Hydrochloric Acid SCHEMBL29977490 | 0.89 | PTGER3 (0.45) | PTGER3SPRTNKSPARP1TNKS2 | |
| Hydrochloric Acid SCHEMBL23112585 | 0.89 | PTGER3 (0.45) | PTGER3SPRTNKSPARP1TNKS2 | |
| Acetic Acid SCHEMBL23112324 | 0.84 | FOS (0.44) | ADORA3GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL29977302 | 0.81 | PTGER3 (0.39) | ADORA3PTGER3GABRPGABRDGABRA1 | |
| SCHEMBL23112399 | 0.81 | PTGER3 (0.39) | ADORA3PTGER3GABRPGABRDGABRA1 | |
| SCHEMBL23112458 | 0.80 | PTGER3 (0.40) | ADORA3PTGER3GABRPGABRDGABRA1 | |
| SCHEMBL26071803 | 0.80 | ADORA3 (0.42) | ADORA3GABRPGABRDGABRA1GABRB1 |
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-3793559-A1 | SUBSTITUTED DIHYDROPYRAZOLO PYRAZINE CARBOXAMIDE DERIVATIVES | Bayer Aktiengesellschaft (DE) | 2021-03-24 | — | — | EP | disclosed |
| CN-112469412-A | Substituted dihydropyrazolopyrazine carboxamide derivatives | 拜耳公司 | 2021-03-09 | — | — | CN | disclosed |