Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | NLRP3 | Q96P20 | 2/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.35 |
| ▸ | ANPEP | P15144 | 1/20 | 0.35 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.34 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.34 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.34 |
| ▸ | CACNA1C | Q13936 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL20236002 | 0.81 | ALDH1A1 (0.43) | ALDH1A1OPRM1 | |
| SCHEMBL5115246 | 0.81 | OPRD1 (0.46) | OPRM1OPRD1OPRK1 | |
| SCHEMBL5115242 | 0.81 | OPRD1 (0.46) | OPRM1OPRD1OPRK1 | |
| Hydrochloric Acid SCHEMBL20236003 | 0.81 | ALDH1A1 (0.43) | ALDH1A1OPRM1 | |
| Hydrochloric Acid SCHEMBL5775220 | 0.80 | OPRD1 (0.46) | OPRM1OPRD1OPRK1 | |
| Hydrochloric Acid SCHEMBL5775227 | 0.80 | OPRD1 (0.46) | OPRM1OPRD1OPRK1 | |
| SCHEMBL15705239 | 0.77 | NLRP3 (0.38) | GPR35NLRP3ANPEP | |
| SCHEMBL24012345 | 0.77 | ALDH1A1 (0.40) | ALDH1A1OPRM1OPRD1OPRK1 | |
| SCHEMBL5569674 | 0.76 | DPP4 (0.48) | ALDH1A1NLRP3ANPEP | |
| SCHEMBL16060347 | 0.76 | DPP4 (0.48) | ALDH1A1NLRP3ANPEP |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019197274-A1 | PROCESS FOR THE PREPARATION OF OPIOID MODULATORS | QUIMICA SINTETICA, S. A. (ES) | 2019-10-17 | — | — | WO | disclosed |