Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 7/20 | 0.69 |
| ▸ | GABRB2 | P47870 | 6/20 | 0.69 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.69 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.69 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.69 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.69 |
| ▸ | LMNA | P02545 | 1/20 | 0.69 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.69 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.69 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.69 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.69 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.58 |
| ▸ | GPBAR1 | Q8TDU6 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28190853 | 1.00 | GABRA1 (0.69) | GABRA1GABRB2CYP1A2CYP3A4CYP11B1 | |
| SCHEMBL18202376 | 0.89 | GABRA1 (0.76) | GABRA1GABRB2CYP1A2CYP3A4CYP11B1 | |
| SCHEMBL18202375 | 0.89 | GABRA1 (0.76) | GABRA1GABRB2CYP1A2CYP3A4CYP11B1 | |
| SCHEMBL18202377 | 0.89 | GABRA1 (0.76) | GABRA1GABRB2CYP1A2CYP3A4CYP11B1 | |
| SCHEMBL22696936 | 0.85 | GABRA1 (0.74) | GABRA1GABRB2CYP1A2CYP3A4CYP11B1 | |
| SCHEMBL11799319 | 0.85 | GABRA1 (0.74) | GABRA1GABRB2CYP1A2CYP3A4CYP11B1 | |
| SCHEMBL4390789 | 0.85 | GABRA1 (0.77) | GABRA1GABRB2CYP1A2CYP3A4CYP11B1 | |
| SCHEMBL28853680 | 0.85 | GABRA1 (0.77) | GABRA1GABRB2CYP1A2CYP3A4CYP11B1 | |
| Propoxate SCHEMBL1817957 | 0.85 | GABRA1 (0.81) | GABRA1GABRB2CYP1A2CYP3A4CYP11B1 | |
| SCHEMBL22696745 | 0.84 | GABRA1 (0.76) | GABRA1GABRB2CYP1A2CYP3A4CYP11B1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107445898-A | N substituted imidazole carboxylic acid ester compounds and preparation method thereof and purposes in medicine | 四川海思科制药有限公司 | 2017-12-08 | — | — | CN | disclosed |