Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Acetaminophen. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.64 |
| ▸ | MAPT | P10636 | 3/20 | 0.64 |
| ▸ | HPGD | P15428 | 3/20 | 0.64 |
| ▸ | GAA | P10253 | 3/20 | 0.64 |
| ▸ | NPC1 | O15118 | 3/20 | 0.64 |
| ▸ | RAB9A | P51151 | 3/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.64 |
| ▸ | THRB | P10828 | 1/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.61 |
| ▸ | HTT | P42858 | 2/20 | 0.61 |
| ▸ | APP | P05067 | 1/20 | 0.60 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.60 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | CA12 | O43570 | 1/20 | 0.57 |
| ▸ | BRD4 | O60885 | 1/20 | 0.57 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.57 |
| ▸ | CA1 | P00915 | 1/20 | 0.57 |
| ▸ | CA2 | P00918 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| Acetaminophen SCHEMBL28460916 | 0.99 | ALDH1A1 (0.62) | ALDH1A1MAPTHPGDGAANPC1 | |
| Acetaminophen SCHEMBL28460914 | 0.86 | ALDH1A1 (0.61) | ALDH1A1MAPTHPGDGAANPC1 | |
| Acetaminophen SCHEMBL27093528 | 0.83 | MAPT (0.71) | ALDH1A1MAPTHPGDGAANPC1 | |
| 4-Hydroxyacetophenone SCHEMBL27691873 | 0.82 | ALDH1A1 (0.68) | ALDH1A1MAPTHPGDGAANPC1 | |
| SCHEMBL6325974 | 0.81 | ALDH1A1 (0.68) | ALDH1A1MAPTHPGDGAANPC1 | |
| SCHEMBL5384036 | 0.80 | ROCK2 (0.76) | ALDH1A1MAPTHPGDGAANPC1 | |
| Niacin SCHEMBL28069837 | 0.80 | GAA (0.81) | ALDH1A1GAAKMT2AAPPHCAR3 | |
| Acedoben SCHEMBL9724003 | 0.80 | MAPT (0.77) | ALDH1A1MAPTHPGDGAANPC1 | |
| Niacin SCHEMBL5694321 | 0.79 | ALDH1A1 (0.88) | ALDH1A1GAATHRBHTTAPP | |
| Niacin SCHEMBL28356771 | 0.79 | ALDH1A1 (0.88) | ALDH1A1GAATHRBHTTAPP |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107501570-B | Metal cadmium coordination polymer and preparation method thereof | 金华职业技术学院 | 2020-09-29 | — | — | CN | claimed |
| CN-107759800-B | Nicotinic acid p-acetaminophenyl ester copper coordination polymer and preparation method thereof | 金华职业技术学院 | 2020-09-29 | — | — | CN | claimed |
| CN-107602623-B | Transition metal cobalt complex containing multi-coordination sites and preparation method thereof | 金华职业技术学院 | 2020-07-07 | — | — | CN | claimed |
| CN-107501570-B | Metal cadmium coordination polymer and preparation method thereof | 金华职业技术学院 | 2020-09-29 | — | — | CN | disclosed |
| CN-107759800-B | Nicotinic acid p-acetaminophenyl ester copper coordination polymer and preparation method thereof | 金华职业技术学院 | 2020-09-29 | — | — | CN | disclosed |
| CN-107602623-B | Transition metal cobalt complex containing multi-coordination sites and preparation method thereof | 金华职业技术学院 | 2020-07-07 | — | — | CN | disclosed |