Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.31 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
| ▸ | DRD1 | P21728 | 1/20 | 0.31 |
| ▸ | HRH2 | P25021 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11611121 | 0.98 | CYP2C19 (0.31) | CYP2C19 | |
| SCHEMBL2124257 | 0.98 | CYP2C19 (0.31) | CYP2C19 | |
| SCHEMBL5321582 | 0.98 | CYP2C19 (0.31) | CYP2C19 | |
| Hydrochloric Acid SCHEMBL4260557 | 0.96 | MEN1 (0.31) | CYP3A4MEN1MAPK1PMP22KMT2A | |
| SCHEMBL6215052 | 0.93 | CYP1A2 (0.33) | CYP1A2ALDH1A1 | |
| SCHEMBL6680402 | 0.93 | CYP1A2 (0.33) | CYP1A2ALDH1A1 | |
| SCHEMBL3865460 | 0.93 | CYP1A2 (0.33) | CYP1A2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL5898246 | 0.91 | CYP1A2 (0.33) | CYP1A2 | |
| Hydrochloric Acid SCHEMBL6218699 | 0.91 | CYP1A2 (0.33) | CYP1A2 | |
| Hydrochloric Acid SCHEMBL4235768 | 0.91 | CYP1A2 (0.33) | CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007091110-A1 | ENZYMATIC RESOLUTION PROCESS FOR THE PREPARATION OF CYCLI-C BETA-AMINO ACID AND ESTER ENATIOMERS | SZEGEDI TUDOMANYEGYETEM (HU) | 2007-08-16 | — | — | WO | claimed |