Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 2/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.43 |
| ▸ | HTR3B | O95264 | 1/20 | 0.43 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.43 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.35 |
| ▸ | MMP8 | P22894 | 2/20 | 0.35 |
| ▸ | MMP3 | P08254 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9582950 | 1.00 | HTR3A (0.43) | HTR3AADRA2AADRA2BADRA2CSLC6A4 | |
| Oxalic Acid SCHEMBL9582569 | 0.97 | HTR3A (0.42) | HTR3AADRA2AADRA2BADRA2CSLC6A4 | |
| SCHEMBL9582228 | 0.84 | HTR3A (0.38) | HTR3AADRA2AADRA2BADRA2CSLC6A4 | |
| SCHEMBL9582692 | 0.84 | HTR3A (0.38) | HTR3AADRA2AADRA2BADRA2CSLC6A4 | |
| Hydrochloric Acid SCHEMBL9581714 | 0.82 | HTR3A (0.37) | HTR3AADRA2AADRA2BADRA2CSLC6A4 | |
| SCHEMBL21515924 | 0.81 | HTR3A (0.38) | HTR3AADRA2AADRA2BADRA2CSLC6A4 | |
| SCHEMBL9582201 | 0.79 | RAB9A (0.42) | SMN1; SMN2POLB | |
| SCHEMBL9582609 | 0.77 | MMP8 (0.41) | HTR3AADRA2AADRA2BADRA2CSLC6A4 | |
| SCHEMBL9581650 | 0.77 | MMP8 (0.41) | HTR3AADRA2AADRA2BADRA2CSLC6A4 | |
| SCHEMBL9582387 | 0.76 | SMN1; SMN2 (0.38) | HTR3AADRA2AADRA2BADRA2CSLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-5262537-A | Treatment of nausea and vomiting | ANAQUEST, INC. (US) | 1993-11-16 | — | — | US | disclosed |