Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.62 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.47 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.47 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.47 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.47 |
| ▸ | NAAA | Q02083 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | MLNR | O43193 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5844533 | 0.89 | ALDH1A1 (0.50) | SMN1; SMN2CHRM1CHRM3CHRM4CHRM5 | |
| Hydrochloric Acid SCHEMBL5843353 | 0.88 | ALDH1A1 (0.52) | SMN1; SMN2CHRM1CHRM3CHRM4CHRM5 | |
| SCHEMBL8708433 | 0.87 | SMN1; SMN2 (0.68) | SMN1; SMN2CHRM1CHRM3CHRM4CHRM5 | |
| SCHEMBL8709262 | 0.87 | SMN1; SMN2 (0.68) | SMN1; SMN2CHRM1CHRM3CHRM4CHRM5 | |
| SCHEMBL8709259 | 0.87 | SMN1; SMN2 (0.68) | SMN1; SMN2CHRM1CHRM3CHRM4CHRM5 | |
| SCHEMBL8708430 | 0.87 | SMN1; SMN2 (0.68) | SMN1; SMN2CHRM1CHRM3CHRM4CHRM5 | |
| SCHEMBL12321236 | 0.86 | SMN1; SMN2 (0.57) | SMN1; SMN2CHRM1CHRM3CHRM4CHRM5 | |
| SCHEMBL30142083 | 0.86 | SMN1; SMN2 (0.57) | SMN1; SMN2CHRM1CHRM3CHRM4CHRM5 | |
| SCHEMBL19975925 | 0.80 | SMN1; SMN2 (0.59) | SMN1; SMN2CHRM1NAAATP53MAPT | |
| SCHEMBL9220454 | 0.80 | SMN1; SMN2 (0.44) | SMN1; SMN2NAAATP53ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| JP-2001002637-A | DERIVATIVES OF OPTICALLY ACTIVE N-SUBSTITUTED PYRROLIDINE, PIPERIDINE DERIVATIVE AND REAGENT FOR ASSAYING ACTIVITY OF BUTYRYL CHOLINE ESTERASE IN BRAIN CONTAINING THE SAME | JAPAN SCIENCE & TECHNOLOGY CORP | 2001-01-09 | — | — | JP | disclosed |