Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | TET3 | O43151 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | FBXL19 | Q6PCT2 | 3/20 | 0.35 |
| ▸ | CXXC5 | Q7LFL8 | 3/20 | 0.35 |
| ▸ | KDM2B | Q8NHM5 | 3/20 | 0.35 |
| ▸ | CXXC4 | Q9H2H0 | 3/20 | 0.35 |
| ▸ | KDM2A | Q9Y2K7 | 3/20 | 0.35 |
| ▸ | TET1 | Q8NFU7 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | TEAD3 | Q99594 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22296231 | 0.90 | HTT (0.42) | CYP1A2TDP1POLBKMT2ATEAD3 | |
| SCHEMBL180337 | 0.86 | CYP1A2 (0.54) | CYP1A2TDP1POLBHTR1ATET3 | |
| SCHEMBL4000585 | 0.78 | HTT (0.52) | CYP1A2TDP1POLBKMT2AHTT | |
| SCHEMBL11127056 | 0.78 | CYP1A2 (0.46) | CYP1A2TDP1POLBGAAHTT | |
| SCHEMBL167151 | 0.77 | TET3 (0.47) | TET3KMT2AFBXL19CXXC5KDM2B | |
| SCHEMBL20547259 | 0.77 | TET3 (0.47) | TET3KMT2AFBXL19CXXC5KDM2B | |
| SCHEMBL12764449 | 0.77 | TET3 (0.47) | TET3KMT2AFBXL19CXXC5KDM2B | |
| SCHEMBL237862 | 0.77 | — | — | |
| SCHEMBL30831288 | 0.76 | ALDH1A1 (0.44) | TET3KMT2AFBXL19CXXC5KDM2B | |
| SCHEMBL9445053 | 0.75 | ACHE (0.37) | TET3KMT2AFBXL19CXXC5KDM2B |
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 |
|---|---|---|---|---|---|---|---|
| EP-3689871-A1 | 4,6,7-TRISUBSTITUTED 1,2-DIHYDROPYRROL[3,4-C]PYRIDIN/PYRIMIDIN-3-ONE DERIVATIVE AND USE | Shanghai Haiyan Pharmaceutical Technology Co., Ltd. (CN) | 2020-08-05 | — | — | EP | disclosed |