Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.42 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.40 |
| ▸ | FNTA | P49354 | 2/20 | 0.39 |
| ▸ | FNTB | P49356 | 2/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.39 |
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.39 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.38 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | UBE2M | P61081 | 2/20 | 0.37 |
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 | 0.89 | AGTR2 (0.43) | OPRK1CHRM2CHRM4AGTR2OPRM1 | |
| SCHEMBL8206397 | 0.89 | AGTR2 (0.38) | ALDH1A1OPRK1FNTAFNTBCHRM2 | |
| SCHEMBL8206924 | 0.84 | AGTR2 (0.43) | ALDH1A1OPRK1CHRM2CHRM4AGTR2 | |
| SCHEMBL8206641 | 0.82 | SLC6A4 (0.40) | ALDH1A1OPRK1CHRM2CHRM4AGTR2 | |
| SCHEMBL8206102 | 0.81 | MCHR1 (0.41) | KDM4EALDH1A1OPRK1CHRM2AGTR2 | |
| SCHEMBL8199247 | 0.81 | AGTR2 (0.42) | OPRK1CHRM2CHRM4AGTR2OPRM1 | |
| SCHEMBL8207101 | 0.80 | CHRM2 (0.46) | ALDH1A1CHRM2GRM2OPRM1CHRM1 | |
| Hydrochloric Acid SCHEMBL8209836 | 0.79 | AGTR2 (0.47) | OPRK1AGTR2OPRM1 | |
| SCHEMBL8206406 | 0.78 | UBE2M (0.40) | KDM4EALDH1A1OPRK1CHRM2CHRM4 | |
| SCHEMBL8207010 | 0.78 | CHRM2 (0.41) | ALDH1A1LMNACHRM2CYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0999205-A1 | AMINOCYCLOALKANE COMPOUNDS | Mitsubishi-Tokyo Pharmaceuticals, Inc. (JP) | 2000-05-10 | — | — | EP | disclosed |