Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 9/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 6/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 6/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.35 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.34 |
| ▸ | HTR3B | O95264 | 1/20 | 0.34 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.34 |
| ▸ | HTR3A | P46098 | 1/20 | 0.34 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.34 |
| ▸ | HTR3C | Q8WXA8 | 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 | |
|---|---|---|---|---|
| SCHEMBL7653279 | 1.00 | CHRM3 (0.40) | CHRM3CHRM2CHRM1LMNACYP2C9 | |
| SCHEMBL7660629 | 0.91 | CHRM3 (0.39) | CHRM3CHRM2CHRM1LMNACYP2C9 | |
| SCHEMBL7660630 | 0.91 | CHRM3 (0.39) | CHRM3CHRM2CHRM1LMNACYP2C9 | |
| SCHEMBL7654077 | 0.88 | CHRM3 (0.37) | CHRM3CHRM2CHRM1LMNACYP2C9 | |
| SCHEMBL7654073 | 0.88 | CHRM3 (0.37) | CHRM3CHRM2CHRM1LMNACYP2C9 | |
| SCHEMBL7662667 | 0.88 | CHRM3 (0.37) | CHRM3CHRM2CHRM1LMNACYP2C9 | |
| SCHEMBL7662673 | 0.88 | CHRM3 (0.37) | CHRM3CHRM2CHRM1LMNACYP2C9 | |
| SCHEMBL7650511 | 0.83 | CHRM3 (0.34) | CHRM3CHRM2CHRM1LMNACYP2C9 | |
| SCHEMBL8396988 | 0.83 | CHRM3 (0.42) | CHRM3CHRM2CHRM1LMNACYP2C9 | |
| SCHEMBL8396984 | 0.83 | CHRM3 (0.42) | CHRM3CHRM2CHRM1LMNACYP2C9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6376510-B1 | ADMINISTERING A ALKOXY- AND ACYLOXY-SUBSTITUTED ARALKYL AND ARALKENYL BIS QUATERNARY AMMONIUM DERIVATIVES OF CYCLIC ALKANOL DIESTERS TO A HUMAN AS MUSCLE RELAXANTS | NEWLAXANT LLC | 2002-04-23 | — | — | US | disclosed |
| US-5990124-A | ALKOXY AND/OR ACYLOXY DI- AND POLY-SUBSTITUTED ARALKYL AND ARALKENYL BIS-QUATERNARY AMMONIUM DERIVATIVES OF CYCLIC ALKANOL DIESTERS; SUCH AS BIS(N-(4-ACETOXY-3-METHOXYBENZYL) TROPANIUM-3-YL)-3,6-ENDOMETHYLENE-1,2,3,6-TETRAHYDROPHTHALATE | GYERMEK LASZLO (US) | 1999-11-23 | — | — | US | disclosed |