Pantothenic Acid

Pantothenic Acid

SCHEMBL27833352

CC(C)(CO)[C@@H](O)C(=O)NCCC(=O)[O-].O.[Na+]

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

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

The experimentally established mechanism targets of Pantothenic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGS1 known ✓ P23219 1/20 0.61
MEN1 known ✓ O00255 1/20 0.32
KCNH2 Q12809 1/20 0.61
VNN1 O95497 13/20 0.53
BBOX1 O75936 1/20 0.34
USP2 O75604 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
CA1 P00915 1/20 0.32

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
Pantothenic Acid SCHEMBL27833355 1.00 PTGS1 (0.61) PTGS1KCNH2VNN1BBOX1MEN1
Pantothenic Acid SCHEMBL27833357 1.00 PTGS1 (0.61) PTGS1KCNH2VNN1BBOX1MEN1
Pantothenic Acid SCHEMBL27833354 1.00 PTGS1 (0.61) PTGS1KCNH2VNN1BBOX1MEN1
Pantothenic Acid SCHEMBL124921 0.98 PTGS1 (0.63) PTGS1KCNH2VNN1BBOX1MEN1
Pantothenic Acid SCHEMBL29390839 0.98 PTGS1 (0.63) PTGS1KCNH2VNN1BBOX1MEN1
Pantothenic Acid SCHEMBL124920 0.98 PTGS1 (0.63) PTGS1KCNH2VNN1BBOX1MEN1
Pantothenic Acid SCHEMBL10774482 0.98 PTGS1 (0.63) PTGS1KCNH2VNN1BBOX1MEN1
Pantothenic Acid SCHEMBL27903325 0.98 PTGS1 (0.63) PTGS1KCNH2VNN1BBOX1MEN1
Pantothenic Acid SCHEMBL7084078 0.97 PTGS1 (0.61) PTGS1KCNH2VNN1BBOX1MEN1
Pantothenic Acid SCHEMBL7084077 0.97 PTGS1 (0.61) PTGS1KCNH2VNN1BBOX1MEN1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103145579-B Sodium pantothenate compound, and composition preparation containing it SHANXI PUDE PHARMACEUTICS CO LTD 2014-12-17 CN disclosed
CN-103145579-A Sodium pantothenate compound, and composition preparation containing it SHANXI PUDE PHARMACEUTICS CO LTD 2013-06-12 CN disclosed
CN-101904862-B Water-soluble vitamin composition freeze-drying preparation for injection SHANDONG LUOXIN PHARMACEUTICAL CO LTD 2011-06-29 CN disclosed
CN-101904862-B Water-soluble vitamin composition freeze-drying preparation for injection SHANDONG LUOXIN PHARMACEUTICAL CO LTD 2011-06-29 CN disclosed
CN-101904862-A Water-soluble vitamin composition freeze-drying preparation for injection SHANDONG LUOXIN PHARMACY STOCK 2010-12-08 CN disclosed
CN-101904862-A Water-soluble vitamin composition freeze-drying preparation for injection SHANDONG LUOXIN PHARMACY STOCK 2010-12-08 CN disclosed