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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | SLC5A7 | Q9GZV3 | 1/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 6/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 6/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 6/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 5/20 | 0.33 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.33 |
| ▸ | SCN1A | P35498 | 3/20 | 0.33 |
| ▸ | SCN2A | Q99250 | 3/20 | 0.33 |
| ▸ | SCN3A | Q9NY46 | 3/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 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 SCHEMBL9687712 | 0.89 | MEN1 (0.35) | MEN1LMNAKMT2ACYP3A4SLC5A7 | |
| Choline SCHEMBL9687698 | 0.86 | LMNA (0.38) | MEN1LMNAKMT2ACYP3A4SLC5A7 | |
| Choline SCHEMBL9687789 | 0.80 | MEN1 (0.31) | MEN1LMNAKMT2ACYP3A4SLC5A7 | |
| Choline SCHEMBL9015240 | 0.75 | CHRM2 (0.38) | MEN1LMNAKMT2ACYP3A4KIF11 | |
| Choline SCHEMBL11726983 | 0.74 | MEN1 (0.50) | MEN1LMNAKMT2ACYP3A4SLC5A7 | |
| Choline SCHEMBL9687798 | 0.74 | MEN1 (0.30) | MEN1LMNAKMT2ACYP3A4SLC5A7 | |
| Choline SCHEMBL9687783 | 0.70 | MEN1 (0.32) | MEN1LMNAKMT2ACYP3A4SLC5A7 | |
| Tetramethylammonium Ion SCHEMBL8397669 | 0.69 | ALDH1A1 (0.39) | MEN1KMT2ACYP3A4KIF11CHRM2 | |
| SCHEMBL25601932 | 0.69 | KIF11 (0.59) | KIF11CHRM2CHRM1CHRM3CHRM4 | |
| Choline SCHEMBL30996806 | 0.69 | MEN1 (0.75) | MEN1LMNAKMT2ACYP3A4SLC5A7 |
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 |