Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 4/20 | 0.38 |
| ▸ | HTR1A | P08908 | 3/20 | 0.33 |
| ▸ | DRD2 | P14416 | 3/20 | 0.33 |
| ▸ | DRD4 | P21917 | 3/20 | 0.33 |
| ▸ | HTR2A | P28223 | 3/20 | 0.33 |
| ▸ | HTR2C | P28335 | 3/20 | 0.33 |
| ▸ | HTR7 | P34969 | 3/20 | 0.33 |
| ▸ | DRD3 | P35462 | 3/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.33 |
| ▸ | CNR2 | P34972 | 3/20 | 0.32 |
| ▸ | CNR1 | P21554 | 2/20 | 0.32 |
| ▸ | TACR3 | P29371 | 1/20 | 0.32 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.32 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.31 |
| ▸ | OXTR | P30559 | 1/20 | 0.31 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.31 |
| ▸ | GRM5 | P41594 | 3/20 | 0.31 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL30605686 | 0.85 | CNR1 (0.40) | P2RX7CNR2CNR1RIPK1PTGER1 | |
| SCHEMBL30558695 | 0.80 | MAPK14 (0.36) | P2RX7CNR2CNR1GRM5PTGER1 | |
| SCHEMBL24409790 | 0.76 | P2RX7 (0.38) | P2RX7HTR1ADRD2DRD4HTR2A | |
| SCHEMBL30697304 | 0.76 | P2RX7 (0.38) | P2RX7HTR1ADRD2DRD4HTR2A | |
| SCHEMBL24409835 | 0.76 | P2RX7 (0.40) | P2RX7HTR1ADRD2DRD4HTR2A | |
| SCHEMBL29525358 | 0.76 | P2RX7 (0.40) | P2RX7HTR1ADRD2DRD4HTR2A | |
| SCHEMBL29525135 | 0.76 | P2RX7 (0.40) | P2RX7HTR1ADRD2DRD4HTR2A | |
| SCHEMBL24409743 | 0.76 | P2RX7 (0.37) | P2RX7HTR1ADRD2DRD4HTR2A | |
| SCHEMBL30519965 | 0.76 | P2RX7 (0.37) | P2RX7HTR1ADRD2DRD4HTR2A | |
| SCHEMBL30609050 | 0.71 | CNR1 (0.40) | P2RX7CNR2CNR1PTGER1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116528674-A | [ (1, 5-bis (heteroaryl) -1H-1,2, 4-triazol-3-yl) oxy ] acetic acid derivatives as safeners for protecting useful plants and crop plants | 拜耳公司 | 2023-08-01 | — | — | CN | disclosed |