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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | SLC5A7 | Q9GZV3 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.48 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.35 |
| ▸ | TERT | O14746 | 5/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.30 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.30 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | CHRM3 | P20309 | 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 SCHEMBL27908542 | 0.74 | LMNA (0.50) | MEN1LMNAKMT2ACYP3A4SLC5A7 | |
| Choline SCHEMBL30396311 | 0.74 | LMNA (0.50) | MEN1LMNAKMT2ACYP3A4SLC5A7 | |
| Choline SCHEMBL5586408 | 0.72 | — | — | |
| Choline SCHEMBL3785871 | 0.72 | — | — | |
| Choline SCHEMBL16558587 | 0.72 | — | — | |
| Choline SCHEMBL300867 | 0.72 | MEN1 (0.92) | MEN1LMNAKMT2ACYP3A4SLC5A7 | |
| Choline SCHEMBL17629823 | 0.72 | MEN1 (0.92) | MEN1LMNAKMT2ACYP3A4SLC5A7 | |
| Choline SCHEMBL8012313 | 0.72 | MEN1 (0.92) | MEN1LMNAKMT2ACYP3A4SLC5A7 | |
| Choline SCHEMBL29394392 | 0.72 | — | — | |
| Choline SCHEMBL13169639 | 0.72 | — | — |
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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-3123706-A | — | — | None | — | — | JP | disclosed |
| JP-55151504-A | — | — | None | — | — | JP | disclosed |
| JP-54055728-A | — | — | None | — | — | JP | disclosed |
| JP-54092627-A | — | — | None | — | — | JP | disclosed |
| JP-58164501-A | — | — | None | — | — | JP | disclosed |
| JP-54129127-A | — | — | None | — | — | JP | disclosed |
| JP-58057303-A | — | — | None | — | — | JP | disclosed |
| JP-7247247-A | — | — | None | — | — | JP | disclosed |
| JP-54119034-A | — | — | None | — | — | JP | disclosed |
| US-7829499-B2 | Granular pesticide preparation | KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) | 2010-11-09 | — | — | US | disclosed |
| JP-H03123706-A | PLANT GROWTH-MODULATING AGENT | CHUGAI PHARMACEUT CO LTD | 1991-05-27 | — | — | JP | disclosed |
| US-4685951-A | CHLOROBENZOYLAMINO-PYRAZOLYL-ACETONITRILES | SUMITOMO CHEMICAL COMPANY, LTD. (JP) | 1987-08-11 | — | — | US | disclosed |
| JP-S58164501-A | PLANT GROWTH REGULATOR | CHUGAI PHARMACEUT CO LTD | 1983-09-29 | — | — | JP | disclosed |
| JP-S5857303-A | PLANT GROWTH REGULATOR | CHUGAI PHARMACEUT CO LTD | 1983-04-05 | — | — | JP | disclosed |
| JP-S55151504-A | HERBICIDE COMPOSITION | MITSUBISHI GAS CHEM CO INC | 1980-11-26 | — | — | JP | disclosed |
| JP-S54129127-A | HERBICIDAL COMPOSITION | MEIJI SEIKA KAISHA LTD | 1979-10-06 | — | — | JP | disclosed |
| JP-S54119034-A | HERBICIDAL COMPOSITION | MEIJI SEIKA KAISHA LTD | 1979-09-14 | — | — | JP | disclosed |
| JP-S5492627-A | HERBICIDAL COMPOSITION | MEIJI SEIKA KAISHA LTD | 1979-07-23 | — | — | JP | disclosed |
| JP-S5455728-A | HERBICIDE FOR PERENNIAL WEED | MITSUBISHI GAS CHEM CO INC | 1979-05-04 | — | — | JP | disclosed |
| JP-S05492627-A | — | — | 0001-01-01 | — | — | JP | disclosed |