Known targets — ChEMBL curated mechanism
ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4
The experimentally established mechanism targets of Imidazole. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 1/20 | 0.30 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.30 |
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | FKBP5 | Q13451 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 2/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Imidazole SCHEMBL642479 | 0.98 | ALDH1A1 (0.54) | ALDH1A1FKBP5CYP3A4TDP1KDM4E | |
| Biphenyl SCHEMBL28667880 | 0.81 | ALDH1A1 (0.59) | ALDH1A1FKBP5CYP3A4KDM4E | |
| Benzene SCHEMBL28896671 | 0.80 | ALDH1A1 (0.81) | ALDH1A1FKBP5TDP1 | |
| Biphenyl SCHEMBL986473 | 0.79 | ALDH1A1 (0.62) | ALDH1A1FKBP5CYP3A4KDM4ESLC6A2 | |
| Biphenyl SCHEMBL27756385 | 0.79 | ALDH1A1 (0.62) | ALDH1A1FKBP5CYP3A4KDM4ESLC6A2 | |
| Toluene SCHEMBL28896038 | 0.78 | ALDH1A1 (0.54) | ALDH1A1FKBP5TDP1SLC6A2SLC6A4 | |
| Phenol SCHEMBL30286047 | 0.78 | ALDH1A1 (0.54) | ALDH1A1FKBP5SLC6A2SLC6A4SLC6A3 | |
| Phenol SCHEMBL28247413 | 0.78 | ALDH1A1 (0.54) | ALDH1A1FKBP5SLC6A2SLC6A4SLC6A3 | |
| Phenol SCHEMBL19462651 | 0.78 | ALDH1A1 (0.54) | ALDH1A1FKBP5SLC6A2SLC6A4SLC6A3 | |
| Benzene SCHEMBL29168770 | 0.78 | ALDH1A1 (0.87) | ALDH1A1FKBP5TDP1 |
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-115400799-A | Fuel additive, preparation method thereof and hydrocarbon fuel nanofluid | 天津大学 | 2022-11-29 | — | — | CN | claimed |
| CN-115400799-B | Fuel additive, preparation method thereof and hydrocarbon fuel nanofluid | 天津大学 | 2023-08-01 | — | — | CN | disclosed |
| CN-115400799-A | Fuel additive, preparation method thereof and hydrocarbon fuel nanofluid | 天津大学 | 2022-11-29 | — | — | CN | disclosed |