Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.64 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.64 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.56 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.56 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.56 |
| ▸ | FAAH | O00519 | 3/20 | 0.55 |
| ▸ | CES1 | P23141 | 3/20 | 0.55 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.52 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.52 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.52 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.52 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.52 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.52 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.52 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.52 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.52 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.52 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL8087422 | 1.00 | MAPT (0.64) | MAPTRXFP1HDAC1HDAC2ALOX5 | |
| SCHEMBL2440152 | 0.98 | MAPT (0.61) | MAPTRXFP1HDAC1HDAC2ALOX5 | |
| SCHEMBL7247766 | 0.91 | HDAC1 (0.61) | MAPTRXFP1HDAC1HDAC2ALOX5 | |
| SCHEMBL7771027 | 0.83 | MAPT (0.60) | MAPTRXFP1HDAC1HDAC2ALOX5 | |
| SCHEMBL12040611 | 0.83 | MAPT (0.60) | MAPTRXFP1HDAC1HDAC2ALOX5 | |
| SCHEMBL7771094 | 0.83 | MAPT (0.60) | MAPTRXFP1HDAC1HDAC2ALOX5 | |
| SCHEMBL9052095 | 0.83 | MAPT (0.60) | MAPTRXFP1HDAC1HDAC2ALOX5 | |
| SCHEMBL7771031 | 0.83 | MAPT (0.60) | MAPTRXFP1HDAC1HDAC2ALOX5 | |
| SCHEMBL7771090 | 0.83 | MAPT (0.60) | MAPTRXFP1HDAC1HDAC2ALOX5 | |
| SCHEMBL1603029 | 0.81 | KEAP1 (0.58) | MAPTHDAC1HDAC2HDAC3HDAC4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107021943-B | 7-epi-baccatin III derivatives, and preparation method and application thereof | 中国科学院上海药物研究所 | 2020-12-29 | — | — | CN | disclosed |
| US-4078084-A | Novel hypolipidemic 2-(3,5-di-tert-butyl-4-hydroxyphenyl)thio carboxamides | THE DOW CHEMICAL COMPANY (US) | 1978-03-07 | — | — | US | disclosed |
| US-4076841-A | Hypolipidemic 2-(3,5-di-tert-butyl-4-hydroxyphenyl)thio carboxamides | THE DOW CHEMICAL COMPANY (US) | 1978-02-28 | — | — | US | disclosed |
| US-4029812-A | Novel hypolipidemic 2-(3,5-di-tert-butyl-4-hydroxyphenyl)thio carboxamides | THE DOW CHEMICAL COMPANY (US) | 1977-06-14 | — | — | US | disclosed |