Phosphocholine

Phosphocholine

SCHEMBL5330902

C[N+](C)(C)CCOP(=O)([O-])[O-].O.O.O.O.[Ca+2].[Cl-]

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO

The experimentally established mechanism targets of Phosphocholine. 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
ADRA1A known ✓ P35348 2/20 0.50
ESR1 known ✓ P03372 1/20 0.50
ADORA3 known ✓ P0DMS8 1/20 0.50
AGTR1 known ✓ P30556 1/20 0.50
CHRM5 known ✓ P08912 3/20 0.39
CHRM1 known ✓ P11229 3/20 0.39
CHRM3 known ✓ P20309 3/20 0.39
MEN1 known ✓ O00255 1/20 0.39
CHRM2 known ✓ P08172 2/20 0.38
CHRM4 known ✓ P08173 2/20 0.38
ADRA2A known ✓ P08913 1/20 0.35
HTR1A known ✓ P08908 1/20 0.35
ADRA1D known ✓ P25100 1/20 0.35
HTR1D known ✓ P28221 1/20 0.35
HTR2C known ✓ P28335 1/20 0.35
ADRA1B known ✓ P35368 1/20 0.35
DRD3 known ✓ P35462 1/20 0.35
LMNA P02545 3/20 0.50
AKT1 P31749 2/20 0.50
CDC25A P30304 1/20 0.50

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
Phosphocholine SCHEMBL7646155 0.98 LMNA (0.52) LMNAAKT1ADRA1AESR1ADORA3
Phosphocholine SCHEMBL10717808 0.96 LMNA (0.53) LMNAAKT1ADRA1AESR1ADORA3
Phosphocholine SCHEMBL7174376 0.96 LMNA (0.53) LMNAAKT1ADRA1AESR1ADORA3
Phosphocholine SCHEMBL18192302 0.93 LMNA (0.55) LMNAAKT1ADRA1AESR1ADORA3
Phosphocholine SCHEMBL9447039 0.93 LMNA (0.55) LMNAAKT1ADRA1AESR1ADORA3
Phosphocholine SCHEMBL9447079 0.91 LMNA (0.53) LMNAAKT1ADRA1AESR1ADORA3
Phosphocholine SCHEMBL9447028 0.91 LMNA (0.53) LMNAAKT1ADRA1AESR1ADORA3
Phosphocholine SCHEMBL9335813 0.83 SMN1; SMN2 (0.51) LMNAAKT1ADRA1AESR1ADORA3
Phosphocholine SCHEMBL15525300 0.80 SMN1; SMN2 (0.45) LMNAAKT1ADRA1AESR1ADORA3
Tetrabuthylammonium SCHEMBL28662246 0.79 LMNA (0.65) LMNAAKT1ADRA1AESR1ADORA3

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007145476-A1 A PROCESS FOR PREPARATION OF L-ALPHA-GLYCEROPHOSPHORYL CHOLINE KIM, HYUN JOO (KR) 2007-12-21 WO disclosed