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 | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | SLC5A7 | Q9GZV3 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | SLC7A11 | Q9UPY5 | 1/20 | 0.39 |
| ▸ | CPT2 | P23786 | 1/20 | 0.36 |
| ▸ | CPT1A | P50416 | 1/20 | 0.36 |
| ▸ | GALR3 | O60755 | 1/20 | 0.32 |
| ▸ | SLC22A16 | Q86VW1 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 SCHEMBL8217649 | 1.00 | LMNA (0.43) | LMNAMEN1KMT2ACYP3A4SLC5A7 | |
| Choline SCHEMBL1683103 | 0.85 | LMNA (0.46) | LMNAMEN1KMT2ACYP3A4SLC5A7 | |
| Choline SCHEMBL4594631 | 0.83 | PTGS1 (0.61) | LMNAMEN1KMT2ACYP3A4SLC5A7 | |
| Choline SCHEMBL4594634 | 0.83 | PTGS1 (0.61) | LMNAMEN1KMT2ACYP3A4SLC5A7 | |
| Cadaverine Tartrate SCHEMBL27758938 | 0.82 | PTGS1 (0.47) | LMNAMEN1KMT2ACYP3A4SLC5A7 | |
| Cysteine SCHEMBL3397998 | 0.82 | — | — | |
| Choline SCHEMBL8135842 | 0.81 | PTGS1 (0.59) | LMNAMEN1KMT2ACYP3A4SLC5A7 | |
| Choline SCHEMBL8135850 | 0.81 | PTGS1 (0.59) | LMNAMEN1KMT2ACYP3A4SLC5A7 | |
| Aspartic Acid SCHEMBL6033507 | 0.81 | CPT2 (0.48) | LMNAMEN1KMT2ACYP3A4SLC5A7 | |
| Choline SCHEMBL8135839 | 0.81 | PTGS1 (0.59) | LMNAMEN1KMT2ACYP3A4SLC5A7 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8187489-B1 | Biodegradable ionic liquids for aircraft deicing | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 2012-05-29 | — | — | US | claimed |
| US-8187489-B1 | Biodegradable ionic liquids for aircraft deicing | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 2012-05-29 | — | — | US | disclosed |
| US-4687666-A | N-PARA-TOSYL-L-LYSINE CHLOROMETHYL KETONE | MINISTERIO DE SANIDAD Y ASISTENCIA SOCIAL INSTITUTO VENEZOLANO DE INVESTIGATIONES CIENTIFICAS (VE) | 1987-08-18 | — | — | US | disclosed |