Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | CRHBP | P24387 | 1/20 | 0.46 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.44 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.44 |
| ▸ | S1PR1 | P21453 | 4/20 | 0.43 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.40 |
| ▸ | SLC16A1 | P53985 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | QPCT | Q16769 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10781342 | 0.79 | CYP2C19 (0.58) | CYP2C19CRHBPCRHR2TSHRNR1H2 | |
| SCHEMBL6013668 | 0.77 | CYP2C19 (0.54) | CYP2C19CRHBPCRHR2TSHRNR1H2 | |
| SCHEMBL10779688 | 0.77 | CYP2C19 (0.54) | CYP2C19CRHBPCRHR2TSHRNR1H2 | |
| SCHEMBL10779813 | 0.77 | CYP2C19 (0.54) | CYP2C19CRHBPCRHR2TSHRNR1H2 | |
| SCHEMBL9629634 | 0.77 | CYP2C19 (0.54) | CYP2C19CRHBPCRHR2TSHRNR1H2 | |
| SCHEMBL19827216 | 0.76 | CYP2C19 (0.50) | CYP2C19CRHBPCRHR2TSHRNR1H2 | |
| SCHEMBL12679044 | 0.76 | CYP2C19 (0.50) | CYP2C19CRHBPCRHR2TSHRNR1H2 | |
| SCHEMBL13779235 | 0.76 | CYP2C19 (0.53) | CYP2C19CRHBPCRHR2TSHRNR1H2 | |
| SCHEMBL1199323 | 0.76 | CYP2C19 (0.53) | CYP2C19CRHBPCRHR2TSHRNR1H2 | |
| SCHEMBL10781440 | 0.76 | CYP2C19 (0.53) | CYP2C19CRHBPCRHR2TSHRNR1H2 |
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-105793779-A | Molecular glass mixtures for organic electronics applications | 分子玻璃公司 | 2016-07-20 | — | — | CN | disclosed |