Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1C | Q13936 | 1/20 | 0.43 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.43 |
| ▸ | PTGIR | P43119 | 2/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.39 |
| ▸ | C5AR1 | P21730 | 3/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | HTR6 | P50406 | 1/20 | 0.37 |
| ▸ | CXCR4 | P61073 | 2/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.36 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.36 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.36 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.36 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.36 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6675354 | 0.99 | CACNA1C (0.42) | CACNA1CSCN5APTGIRSIGMAR1C5AR1 | |
| SCHEMBL6675283 | 0.85 | ADRA2A (0.47) | CACNA1CSCN5APTGIRSIGMAR1ADRA2A | |
| Hydrochloric Acid SCHEMBL6677488 | 0.84 | ADRA2A (0.49) | CACNA1CSCN5APTGIRADRA2A | |
| SCHEMBL6676284 | 0.81 | PTGIR (0.45) | CACNA1CSCN5APTGIRSIGMAR1CXCR4 | |
| SCHEMBL6676123 | 0.80 | KCNK3 (0.50) | CACNA1CSCN5AGRIN2DGRIN3BGRIN1 | |
| Hydrochloric Acid SCHEMBL6678108 | 0.80 | PTGIR (0.44) | CACNA1CSCN5APTGIRSIGMAR1ADRA2A | |
| SCHEMBL6674456 | 0.79 | IDO1 (0.38) | IDO1HTR6HDAC8 | |
| SCHEMBL6678178 | 0.78 | C5AR1 (0.60) | C5AR1 | |
| Hydrochloric Acid SCHEMBL6675350 | 0.78 | IDO1 (0.37) | IDO1HTR6HDAC8 | |
| SCHEMBL27495178 | 0.78 | IDO1 (0.37) | IDO1HTR6HDAC8 |
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-0798292-B1 | ANILINE DERIVATIVES HAVING NITROGEN MONOXIDE SYNTHASE INHIBITORY ACTIVITY | CHUGAI SEIYAKUKABUSHIKI KAISHA (JP) | 2004-11-03 | — | — | EP | claimed |