Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 3/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.40 |
| ▸ | TACR1 | P25103 | 2/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.38 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.38 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.38 |
| ▸ | AGTR2 | P50052 | 2/20 | 0.37 |
| ▸ | JAK2 | O60674 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.36 |
| ▸ | JAK1 | P23458 | 1/20 | 0.36 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8199055 | 0.90 | AGTR2 (0.43) | SLC6A4CHRM2CHRM3CHRM1AGTR2 | |
| SCHEMBL8207101 | 0.87 | CHRM2 (0.46) | CHRM2CHRM3CHRM1GRM2GRM3 | |
| SCHEMBL8206924 | 0.85 | AGTR2 (0.43) | SLC6A4CHRM2CHRM3CHRM1AGTR2 | |
| SCHEMBL8206397 | 0.83 | AGTR2 (0.38) | SLC6A4CHRM2CHRM3CHRM1AGTR2 | |
| SCHEMBL8207012 | 0.82 | KDM4E (0.47) | CHRM2CHRM3CHRM1GRM2AGTR2 | |
| SCHEMBL8199247 | 0.81 | AGTR2 (0.42) | SLC6A4CHRM2CHRM3CHRM1AGTR2 | |
| SCHEMBL8206406 | 0.80 | UBE2M (0.40) | SLC6A4CHRM2CHRM3CHRM1ALDH1A1 | |
| SCHEMBL8209731 | 0.80 | HRH1 (0.39) | SLC6A4CHRM2CHRM3CHRM1AGTR2 | |
| Hydrochloric Acid SCHEMBL8209836 | 0.80 | AGTR2 (0.47) | AGTR2OPRM1OPRK1 | |
| SCHEMBL8205150 | 0.79 | ALOX5 (0.41) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0999205-A1 | AMINOCYCLOALKANE COMPOUNDS | Mitsubishi-Tokyo Pharmaceuticals, Inc. (JP) | 2000-05-10 | — | — | EP | claimed |
| EP-0999205-A1 | AMINOCYCLOALKANE COMPOUNDS | Mitsubishi-Tokyo Pharmaceuticals, Inc. (JP) | 2000-05-10 | — | — | EP | disclosed |