Choline

Choline

SCHEMBL337937

C[N+](C)(C)CCO.O=S([O-])O

nearest known ligand 0.63

Full drug profile on Sugi Atlas →

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)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.60
▸ KMT2A Q03164 3/20 0.60
▸ LMNA P02545 2/20 0.60
▸ CYP3A4 P08684 1/20 0.60
▸ SLC5A7 Q9GZV3 1/20 0.60
▸ GALR3 O60755 1/20 0.35
▸ ACHE P22303 2/20 0.32
▸ BBOX1 O75936 3/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ CHRM5 P08912 2/20 0.31
▸ CHRM1 P11229 2/20 0.31
▸ CHRM3 P20309 2/20 0.31
▸ ADRA2A P08913 1/20 0.31
▸ ADRA1A P35348 1/20 0.31
▸ PGR P06401 1/20 0.31
▸ CHRM2 P08172 1/20 0.31
▸ CHRM4 P08173 1/20 0.31
▸ HTR1A P08908 1/20 0.31
▸ CHRNB2 P17787 1/20 0.31
▸ TBXA2R P21731 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.

Compoundsimilaritytop predictedshared targets
Choline SCHEMBL28133686 0.95 CYP3A4 (0.62) MEN1KMT2ALMNACYP3A4SLC5A7
Choline SCHEMBL337935 0.92 MEN1 (0.63) MEN1KMT2ALMNACYP3A4SLC5A7
Choline SCHEMBL27670409 0.89 MEN1 (0.67) MEN1KMT2ALMNACYP3A4SLC5A7
Choline SCHEMBL27597535 0.89 MEN1 (0.67) MEN1KMT2ALMNACYP3A4SLC5A7
Choline SCHEMBL28133687 0.84 MEN1 (0.60) MEN1KMT2ALMNACYP3A4SLC5A7
Choline SCHEMBL3785871 0.80 — —
Choline SCHEMBL11722607 0.80 — —
Choline SCHEMBL3783748 0.80 — —
Choline SCHEMBL3783744 0.80 MEN1 (0.80) MEN1KMT2ALMNACYP3A4SLC5A7
Choline SCHEMBL5586408 0.80 — —

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 68 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8507413-B2 Methods using well drilling fluids having clay control properties CLEARWATER INTERNATIONAL, LLC (US) 2013-08-13 — — US claimed
US-20120118645-A1 METHODS USING WELL DRILLING FLUIDS HAVING CLAY CONTROL PROPERTIES CLEARWATER INTERNATIONAL, LLC (US) 2012-05-17 — — US claimed
US-8097567-B2 Well drilling fluids having clay control properties CLEARWATER INTERNATIONAL, LLC (US) 2012-01-17 — — US claimed
US-20070193708-A1 Composition Comprising Choline Hydroxide And Process For Preparing The same BALCHEM CORPORATION 2007-08-23 — — US claimed
US-20070173414-A1 Well drilling fluids having clay control properties CLEARWATER INTERNATIONAL, INC. 2007-07-26 — — US claimed
CN-1984875-A Composition comprising choline hydroxide and process for preparing the same AKZO NOBEL NV (NL) 2007-06-20 — — CN claimed
EP-1781594-A1 COMPOSITION COMPRISING CHOLINE HYDROXIDE AND PROCESS FOR PREPARING THE SAME Akzo Nobel N.V. (NL) 2007-05-09 — — EP claimed
WO-2006005692-A1 COMPOSITION COMPRISING CHOLINE HYDROXIDE AND PROCESS FOR PREPARING THE SAME AKZO NOBEL N.V. (NL) 2006-01-19 — — WO claimed
US-20040038840-A1 Oxalic acid as a semiaqueous cleaning product for copper and dielectrics EKC TECHNOLOGY, INC. 2004-02-26 — — US claimed
WO-2003091376-A1 OXALIC ACID AS A CLEANING PRODUCT FOR ALUMINIUM, COPPER AND DIELECTRIC SURFACES EKC TECHNOLOGY, INC. (US) 2003-11-06 — — WO claimed
CN-1081569-A agricultural composition for promoting plant photosynthesis SWALLOW ENTERPRISES CO (HK) 1994-02-09 — — CN claimed
US-4735969-A Menadione choline bisulfite adduct, its preparation and antihemorrhagic compositions BASF AKTIENGESELLSCHAFT (DE) 1988-04-05 — — US claimed
EP-0183194-B1 MENADIONCHOLINE-BISULFITE ADDUCT AND PROCESS FOR ITS PREPARATION BASF Aktiengesellschaft (DE) 1987-10-21 — — EP claimed
US-11643384-B2 Stabilization of compositions comprising quaternary trialkylalkanolamine hydroxide KURITA WATER INDUSTRIES LTD. (JP) 2023-05-09 — — US disclosed
EP-3784817-B1 STABILIZATION OF COMPOSITIONS COMPRISING QUATERNARY TRIALKYLALKANOLAMINE HYDROXIDE KURITA WATER IND LTD (JP) 2022-04-20 — — EP disclosed
CN-111712590-B Stabilization of compositions comprising quaternary trialkylalkanolamine hydroxides 栗田工业株式会社 2022-03-25 — — CN disclosed
US-5690988-A DRY CAT FOOD HAVING CHOLINE COMPOUND COLGATE PALMOLIVE COMPANY (US) 1997-11-25 — — US disclosed
WO-1997027762-A1 CAT FOOD COMPOSITION OF IMPROVED PALATABILITY COLGATE-PALMOLIVE COMPANY (US) 1997-08-07 — — WO disclosed
US-4735969-A Menadione choline bisulfite adduct, its preparation and antihemorrhagic compositions BASF AKTIENGESELLSCHAFT (DE) 1988-04-05 — — US disclosed
US-3965263-A Choline salicylate compositions and methods for achieving analgesia THE PURDUE FREDERICK COMPANY (US) 1976-06-22 — — US disclosed
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