Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.49 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.49 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.49 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.48 |
| ▸ | ATM | Q13315 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | DRD4 | P21917 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9720740 | 0.84 | ATM (0.48) | CYP1A2CYP3A4CYP2D6CYP2C19KMT2A | |
| SCHEMBL9720772 | 0.82 | OPRM1 (0.50) | KMT2AOPRM1OPRD1OPRK1OPRL1 | |
| SCHEMBL9720688 | 0.81 | OPRD1 (0.50) | ALDH1A1KMT2AOPRD1OPRK1KDM4E | |
| SCHEMBL9720681 | 0.78 | MAPK1 (0.78) | ALDH1A1KMT2AMAPK1KDM4EDRD4 | |
| Belarizine SCHEMBL2108057 | 0.77 | ATM (0.73) | ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL9720800 | 0.77 | SIGMAR1 (0.56) | KMT2AMAPK1OPRD1OPRK1SIGMAR1 | |
| SCHEMBL9720680 | 0.76 | SIGMAR1 (0.54) | ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL25861444 | 0.74 | HRH3 (0.56) | ALDH1A1KMT2AKDM4EMEN1DRD4 | |
| SCHEMBL9720718 | 0.73 | TRPV6 (0.58) | ALDH1A1KMT2AKDM4EATMMEN1 | |
| SCHEMBL9720752 | 0.73 | DRD4 (0.77) | KMT2ASIGMAR1DRD4 |
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 |
|---|---|---|---|---|---|---|---|
| US-5142052-A | Cationic effect-driven carbinol/amine reaction | LABORATOIRES SYNTEX (FR) | 1992-08-25 | — | — | US | disclosed |