Known targets — ChEMBL curated mechanism
ADORA1ADORA2AADORA2BADORA3GNRHRMPLPDE3APDE3BPDE4APDE4BPDE4CPDE4DPPARASLC5A2
The experimentally established mechanism targets of Choline. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | SLC5A7 | Q9GZV3 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.31 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Choline SCHEMBL9687798 | 0.90 | MEN1 (0.30) | MEN1LMNAKMT2ACYP3A4SLC5A7 | |
| Choline SCHEMBL9687789 | 0.88 | MEN1 (0.31) | MEN1LMNAKMT2ACYP3A4SLC5A7 | |
| SCHEMBL9717859 | 0.87 | CYP2C19 (0.35) | MEN1LMNAKMT2ACHRM2CHRM1 | |
| Choline SCHEMBL9687698 | 0.80 | LMNA (0.38) | MEN1LMNAKMT2ACYP3A4SLC5A7 | |
| Choline SCHEMBL9015236 | 0.73 | SCN1A (0.35) | MEN1LMNAKMT2ACYP3A4CHRM2 | |
| Choline SCHEMBL9687712 | 0.71 | MEN1 (0.35) | MEN1LMNAKMT2ACYP3A4SLC5A7 | |
| SCHEMBL17104413 | 0.70 | ALDH1A1 (0.39) | CYP3A4 | |
| Choline SCHEMBL9687704 | 0.70 | MEN1 (0.36) | MEN1LMNAKMT2ACYP3A4SLC5A7 | |
| Choline SCHEMBL9015244 | 0.68 | CHRM2 (0.38) | MEN1LMNAKMT2ACYP3A4SLC5A7 | |
| SCHEMBL29157603 | 0.66 | ALDH1A1 (0.42) | LMNAKMT2ACYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-5153100-A | Hexaarylbisimidazole and-or p-dialkylaminophenyl carbonyl compound | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1992-10-06 | — | — | US | disclosed |
| EP-0475153-A1 | Borate coinitiators for photopolymerizable compositions | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1992-03-18 | — | — | EP | disclosed |