Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.44 |
| ▸ | DRD1 | P21728 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 4/20 | 0.43 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | F2R | P25116 | 1/20 | 0.41 |
| ▸ | USP30 | Q70CQ3 | 3/20 | 0.40 |
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 SCHEMBL8880491 | 0.99 | RAB9A (0.46) | RAB9ASMN1; SMN2CHRM2CHRM1DRD1 | |
| SCHEMBL8880003 | 0.87 | CHRM2 (0.48) | RAB9ASMN1; SMN2CHRM2CHRM1DRD1 | |
| Hydrochloric Acid SCHEMBL8882119 | 0.86 | ALDH1A1 (0.48) | RAB9ASMN1; SMN2CHRM2CHRM1DRD1 | |
| SCHEMBL8781882 | 0.84 | RAB9A (0.47) | RAB9ASMN1; SMN2CHRM2CHRM1DRD1 | |
| SCHEMBL9461390 | 0.83 | RAB9A (0.46) | RAB9ASMN1; SMN2CHRM2CHRM1DRD1 | |
| Hydrochloric Acid SCHEMBL8788681 | 0.83 | RAB9A (0.46) | RAB9ASMN1; SMN2CHRM2CHRM1DRD1 | |
| Hydrochloric Acid SCHEMBL8881755 | 0.83 | PTPN1 (0.47) | RAB9ASMN1; SMN2CHRM2CHRM1DRD1 | |
| SCHEMBL8880846 | 0.78 | SMN1; SMN2 (0.50) | RAB9ASMN1; SMN2PTPN1MEN1MAPK1 | |
| SCHEMBL9360426 | 0.77 | SMN1; SMN2 (0.49) | RAB9ASMN1; SMN2SLC6A2PTPN1MEN1 | |
| Hydrochloric Acid SCHEMBL8880546 | 0.77 | SMN1; SMN2 (0.49) | RAB9ASMN1; SMN2PTPN1MEN1MAPK1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5602160-A | MUSCLE RELAXANT | MITSUI TOATSU CHEMICALS INCORPORATED (JP) | 1997-02-11 | — | — | US | disclosed |
| US-5498619-A | MUSCLE RELAXANTS, POLLAKIUREA CURING AGENTS AND MUSCLE SPASMS | MITSUI TOATSU CHEMICALS, INCORPORATED (JP) | 1996-03-12 | — | — | US | disclosed |
| EP-0414391-B1 | Aminoketone derivatives and use thereof | MITSUI TOATSU CHEMICALS (JP) | 1995-03-15 | — | — | EP | disclosed |
| US-5338857-A | Muscle relaxant | MITSUI TOATSU CHEMICALS INCORPORATED (JP) | 1994-08-16 | — | — | US | disclosed |
| EP-0414391-A2 | Aminoketone derivatives and use thereof | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1991-02-27 | — | — | EP | disclosed |