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 | |
|---|---|---|---|---|
| ▸ | ADORA3 known ✓ | P0DMS8 | 1/20 | 0.48 |
| ▸ | LPAR5 | Q9H1C0 | 1/20 | 0.59 |
| ▸ | AKT1 | P31749 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | PRKD3 | O94806 | 2/20 | 0.53 |
| ▸ | PRKCG | P05129 | 2/20 | 0.53 |
| ▸ | PRKCB | P05771 | 2/20 | 0.53 |
| ▸ | PRKCA | P17252 | 2/20 | 0.53 |
| ▸ | PRKCH | P24723 | 2/20 | 0.53 |
| ▸ | PRKCI | P41743 | 2/20 | 0.53 |
| ▸ | PRKCE | Q02156 | 2/20 | 0.53 |
| ▸ | PRKCQ | Q04759 | 2/20 | 0.53 |
| ▸ | PRKCZ | Q05513 | 2/20 | 0.53 |
| ▸ | PRKCD | Q05655 | 2/20 | 0.53 |
| ▸ | PRKD1 | Q15139 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | GMNN | O75496 | 1/20 | 0.53 |
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 SCHEMBL28269647 | 1.00 | LPAR5 (0.59) | LPAR5AKT1LMNAPRKD3PRKCG | |
| Choline SCHEMBL31020385 | 0.89 | LPAR5 (0.77) | LPAR5AKT1LMNAPRKD3PRKCG | |
| SCHEMBL258048 | 0.88 | LPAR5 (0.74) | LPAR5AKT1LMNAPRKD3PRKCG | |
| SCHEMBL258036 | 0.88 | LPAR5 (0.74) | LPAR5AKT1LMNAPRKD3PRKCG | |
| SCHEMBL258056 | 0.88 | LPAR5 (0.74) | LPAR5AKT1LMNAPRKD3PRKCG | |
| SCHEMBL258063 | 0.88 | LPAR5 (0.74) | LPAR5AKT1LMNAPRKD3PRKCG | |
| SCHEMBL258058 | 0.88 | LPAR5 (0.74) | LPAR5AKT1LMNAPRKD3PRKCG | |
| SCHEMBL27602487 | 0.87 | LPAR5 (0.72) | LPAR5AKT1LMNAPRKD3PRKCG | |
| SCHEMBL27642051 | 0.87 | LPAR5 (0.71) | LPAR5AKT1LMNAPRKD3PRKCG | |
| Choline SCHEMBL28147311 | 0.86 | LPAR1 (0.60) | LPAR5AKT1LMNAPRKD3PRKCG |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110520409-A | Compounds and compositions for intracellular delivery of therapeutic agents | MODERNATX INC | 2019-11-29 | — | — | CN | disclosed |