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 | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.68 |
| ▸ | SLC5A7 | Q9GZV3 | 1/20 | 0.68 |
| ▸ | LMNA | P02545 | 3/20 | 0.60 |
| ▸ | MEN1 | O00255 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.60 |
| ▸ | CHRM5 | P08912 | 3/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.38 |
| ▸ | BLM | P54132 | 3/20 | 0.38 |
| ▸ | APEX1 | P27695 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | BBOX1 | O75936 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
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 SCHEMBL21800980 | 0.89 | CYP3A4 (0.77) | CYP3A4SLC5A7LMNAMEN1KMT2A | |
| Choline SCHEMBL992915 | 0.86 | MEN1 (0.71) | CYP3A4SLC5A7LMNAMEN1KMT2A | |
| Choline SCHEMBL2469440 | 0.83 | MEN1 (0.67) | CYP3A4SLC5A7LMNAMEN1KMT2A | |
| Choline SCHEMBL29118960 | 0.83 | MEN1 (0.77) | CYP3A4SLC5A7LMNAMEN1KMT2A | |
| Choline SCHEMBL28715885 | 0.83 | CYP3A4 (0.87) | CYP3A4SLC5A7LMNAMEN1KMT2A | |
| Choline SCHEMBL14957 | 0.83 | — | — | |
| Choline SCHEMBL2459999 | 0.83 | CYP3A4 (1.00) | CYP3A4SLC5A7LMNAMEN1KMT2A | |
| Choline SCHEMBL1330530 | 0.83 | — | — | |
| Choline SCHEMBL1332010 | 0.83 | — | — | |
| Choline SCHEMBL9391204 | 0.83 | CYP3A4 (1.00) | CYP3A4SLC5A7LMNAMEN1KMT2A |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115806465-A | Separation method of mixed dichlorobenzene | 中国石油化工股份有限公司 | 2023-03-17 | — | — | CN | claimed |
| WO-2017175101-A1 | SYNTHESIS OF COPPER PHTHALOCYANINE USING DEEP EUTECTIC SOLVENT | SHANKARLING G S (IN) | 2017-10-12 | — | — | WO | claimed |
| CN-115806465-A | Separation method of mixed dichlorobenzene | 中国石油化工股份有限公司 | 2023-03-17 | — | — | CN | disclosed |
| WO-2017175101-A1 | SYNTHESIS OF COPPER PHTHALOCYANINE USING DEEP EUTECTIC SOLVENT | SHANKARLING G S (IN) | 2017-10-12 | — | — | WO | disclosed |
| EP-2961268-A1 | SAMPLE FIXATION AND STABILISATION | Goldsborough, Andrew Simon (FR) | 2016-01-06 | — | — | EP | disclosed |
| WO-2014131906-A1 | SAMPLE FIXATION AND STABILISATION | GOLDSBOROUGH ANDREW SIMON (FR) | 2014-09-04 | — | — | WO | disclosed |
| WO-2012145522-A2 | DEEP EUTECTIC SOLVENT SYSTEMS AND METHODS | GEORGIA TECH RESEARCH CORPORATION (US) | 2012-10-26 | — | — | WO | disclosed |
| US-8247198-B2 | Enzymatic processing in deep eutectic solvents | FRIEDRICH SRIENC (US) | 2012-08-21 | — | — | US | disclosed |
| US-20090117628-A1 | Enzymatic processing in deep eutectic solvents | SRIENC, FRIEDRICH | 2009-05-07 | — | — | US | disclosed |