Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 13/20 | 0.55 |
| ▸ | PTPN1 | P18031 | 6/20 | 0.55 |
| ▸ | CES2 | O00748 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | THRA | P10827 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.34 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.34 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1365349 | 0.81 | GSK3B (0.61) | GSK3BPTPN1CES2CES1THRA | |
| SCHEMBL28234292 | 0.80 | SMN1; SMN2 (0.50) | THRATHRBALDH1A1 | |
| SCHEMBL205280 | 0.80 | GSK3B (0.80) | GSK3BPTPN1HDAC3HDAC4HDAC1 | |
| SCHEMBL2776629 | 0.79 | GSK3B (0.63) | GSK3BPTPN1THRATHRBALDH1A1 | |
| SCHEMBL27535076 | 0.79 | SRD5A2 (0.44) | ALDH1A1 | |
| SCHEMBL9237039 | 0.79 | GSK3B (0.64) | GSK3BPTPN1CES2CES1THRA | |
| SCHEMBL6816324 | 0.79 | GSK3B (0.64) | GSK3BPTPN1CES2CES1 | |
| SCHEMBL28228710 | 0.77 | HSD17B3 (0.58) | THRATHRBALDH1A1 | |
| SCHEMBL14198824 | 0.77 | ALDH1A1 (0.61) | THRBALDH1A1 | |
| SCHEMBL6631999 | 0.75 | GSK3B (0.59) | GSK3BPTPN1CES2CES1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103626717-B | compound for pigment | 住友化学株式会社 | 2018-06-05 | — | — | CN | disclosed |
| CN-103987706-B | Pyridione derivatives and the medicine containing Pyridione derivatives | 科研制药株式会社 | 2016-06-29 | — | — | CN | disclosed |
| CN-103987706-A | Pyridone derivative and medicine containing same | KAKEN PHARMA CO LTD | 2014-08-13 | — | — | CN | disclosed |