Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | KLK7 | P49862 | 2/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | SLC18A3 | Q16572 | 3/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.35 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.35 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28066064 | 0.77 | IDO1 (0.47) | ALDH1A1LMNAMAPTCYP2C9SMN1; SMN2 | |
| SCHEMBL28856478 | 0.77 | IDO1 (0.48) | ALDH1A1LMNAMAPTCYP2C9IDO1 | |
| SCHEMBL14379101 | 0.76 | KLK7 (0.46) | ALDH1A1LMNAMAPTCYP2C9KLK7 | |
| SCHEMBL8422977 | 0.72 | GAA (0.43) | ALDH1A1LMNAMAPTL3MBTL1 | |
| SCHEMBL3901891 | 0.72 | ALDH1A1 (0.46) | ALDH1A1LMNAMAPTCYP2C9SMN1; SMN2 | |
| SCHEMBL14612886 | 0.71 | LMNA (0.47) | ALDH1A1LMNAMAPTCYP2C9IDO1 | |
| SCHEMBL27789379 | 0.71 | ALDH1A1 (0.42) | ALDH1A1LMNAMAPTSMN1; SMN2TDP1 | |
| SCHEMBL19029583 | 0.70 | GAA (0.50) | ALDH1A1MAPTKLK7TDP1L3MBTL1 | |
| SCHEMBL180554 | 0.68 | IDO1 (0.49) | ALDH1A1MAPTSMN1; SMN2IDO1SLC18A3 | |
| SCHEMBL27640699 | 0.68 | SLC18A3 (0.62) | ALDH1A1LMNAMAPTCYP2C9IDO1 |
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-103596431-B | Pyrimidine cyclohexyl glucocorticoid receptor modulators | 科赛普特治疗公司 | 2016-06-22 | — | — | CN | disclosed |