Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.70 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.70 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.70 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.70 |
| ▸ | POLB | P06746 | 1/20 | 0.70 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.70 |
| ▸ | PARP1 | P09874 | 1/20 | 0.70 |
| ▸ | TSHR | P16473 | 1/20 | 0.70 |
| ▸ | RECQL | P46063 | 1/20 | 0.70 |
| ▸ | BLM | P54132 | 1/20 | 0.70 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.70 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.70 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.59 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.59 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.59 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.59 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.59 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.59 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.59 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.59 |
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 | |
|---|---|---|---|---|
| Benzamide SCHEMBL27669993 | 0.91 | L3MBTL1 (0.76) | MAPTL3MBTL1CYP2C19TDP1POLB | |
| Benzamide SCHEMBL27669992 | 0.91 | L3MBTL1 (0.76) | MAPTL3MBTL1CYP2C19TDP1POLB | |
| Benzamide SCHEMBL29027531 | 0.88 | TSHR (0.59) | MAPTL3MBTL1CYP2C19TDP1POLB | |
| Benzamide SCHEMBL14574628 | 0.87 | LMNA (0.61) | MAPTL3MBTL1CYP2C19TDP1POLB | |
| Benzamide SCHEMBL8383228 | 0.87 | CES2 (0.59) | MAPTL3MBTL1CYP2C19TDP1POLB | |
| Phenylbutanoic Acid SCHEMBL28207627 | 0.87 | HDAC3 (0.75) | MAPTL3MBTL1CYP2C19TDP1POLB | |
| Terephthalamide SCHEMBL31306314 | 0.86 | TSHR (0.54) | MAPTL3MBTL1CYP2C19TDP1POLB | |
| Heptanoate SCHEMBL29036106 | 0.85 | CES2 (0.60) | MAPTL3MBTL1CYP2C19TDP1POLB | |
| Palmitic Acid SCHEMBL28888259 | 0.85 | CES2 (0.60) | MAPTL3MBTL1CYP2C19TDP1POLB | |
| Stearic Acid SCHEMBL7759093 | 0.85 | CES2 (0.60) | MAPTL3MBTL1CYP2C19TDP1POLB |
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-110078735-A | Pyrrolopyrimidine compounds with anti-tumor activity and application thereof | 河北医科大学 | 2019-08-02 | — | — | CN | disclosed |
| CN-109134295-A | Amerantrone derivative and its preparation method and application | 山东大学 | 2019-01-04 | — | — | CN | disclosed |