Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 1/20 | 0.45 |
| ▸ | PARP1 | P09874 | 3/20 | 0.42 |
| ▸ | ADK | P55263 | 1/20 | 0.41 |
| ▸ | TYMP | P19971 | 1/20 | 0.41 |
| ▸ | GRM5 | P41594 | 3/20 | 0.40 |
| ▸ | TDP2 | O95551 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | CASP2 | P42575 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | CASP6 | P55212 | 1/20 | 0.39 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.39 |
| ▸ | PTP4A3 | O75365 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 3/20 | 0.39 |
| ▸ | MAOB | P27338 | 3/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | TTR | P02766 | 1/20 | 0.38 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7806624 | 0.81 | PARP1 (0.47) | GSK3BPARP1ADKGRM5TDP2 | |
| SCHEMBL28099608 | 0.81 | PARP1 (0.46) | GSK3BPARP1ADKGRM5TDP2 | |
| SCHEMBL28086898 | 0.81 | MEN1 (0.41) | GSK3BADKGRM5LMNAMAPT | |
| SCHEMBL27453644 | 0.80 | GSK3B (0.43) | GSK3BPARP1ADKTDP2LMNA | |
| SCHEMBL28953315 | 0.80 | PPOX (0.44) | GSK3BPARP1ADKTYMPTDP2 | |
| SCHEMBL9051179 | 0.80 | PTGS2 (0.47) | GSK3BPARP1ADKMAPTHTT | |
| Benzene SCHEMBL28099609 | 0.79 | GSK3B (0.50) | GSK3BPARP1GRM5MAPTCASP3 | |
| SCHEMBL8429414 | 0.78 | GSK3B (0.61) | GSK3BPARP1ADKTDP2LMNA | |
| SCHEMBL7392602 | 0.77 | WEE1 (0.43) | PARP1GRM5TDP2CHEK1WEE1 | |
| SCHEMBL1080129 | 0.76 | GSK3B (0.52) | GSK3BPARP1GRM5MAPTCASP3 |
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-105985521-B | A kind of polybenzimidazoles acid imide and preparation method thereof | 中国科学院宁波材料技术与工程研究所 | 2018-11-09 | — | — | CN | disclosed |
| CN-104311825-B | Phenolphthalein type copolyimide and preparation method thereof | 中国科学院宁波材料技术与工程研究所 | 2017-05-17 | — | — | CN | disclosed |