Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | GABRA1 | P14867 | 4/20 | 0.46 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.46 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.43 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | FAAH | O00519 | 2/20 | 0.43 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.43 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL30717958 | 1.00 | CYP3A4 (0.54) | CYP3A4ALDH1A1CYP2C19GABRA1GABRB2 | |
| SCHEMBL27872592 | 0.98 | CYP3A4 (0.53) | CYP3A4ALDH1A1CYP2C19GABRA1GABRB2 | |
| SCHEMBL8959279 | 0.98 | CYP3A4 (0.53) | CYP3A4ALDH1A1CYP2C19GABRA1GABRB2 | |
| SCHEMBL8959276 | 0.77 | CYP3A4 (0.49) | CYP3A4ALDH1A1CYP2C19GABRA1GABRB2 | |
| SCHEMBL22264128 | 0.76 | GABRA1 (0.50) | CYP3A4ALDH1A1CYP2C19GABRA1GABRB2 | |
| SCHEMBL9153083 | 0.75 | G6PD (0.50) | CYP3A4ALDH1A1CYP2C19LMNACA1 | |
| SCHEMBL8958889 | 0.74 | GABRA1 (0.48) | CYP3A4ALDH1A1CYP2C19GABRA1GABRB2 | |
| SCHEMBL11859134 | 0.73 | G6PD (0.48) | CYP3A4ALDH1A1CYP2C19LMNACA2 | |
| SCHEMBL4599401 | 0.73 | ALDH1A1 (0.39) | CYP3A4ALDH1A1CYP2C19CYP1A2TSHR | |
| SCHEMBL11327772 | 0.72 | RNASEH1 (0.38) | CYP3A4ALDH1A1CYP2C19GABRA1GABRB2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101547930-B | Compound and composition containing same | KURARAY MEDICAL INC | 2012-09-19 | — | — | CN | disclosed |
| EP-0408357-A2 | Polymerizable composition | KURARAY CO., LTD. (JP) | 1991-01-16 | — | — | EP | disclosed |