Known targets — ChEMBL curated mechanism
ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO
The experimentally established mechanism targets of Thiamine Ion. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.98 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.68 |
| ▸ | TKT | P29401 | 12/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.64 |
| ▸ | LMNA | P02545 | 1/20 | 0.63 |
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 | |
|---|---|---|---|---|
| Thiamine Ion SCHEMBL28688752 | 0.99 | HSP90AA1 (0.95) | HSP90AA1TDP1TKTKDM4ELMNA | |
| Thiamine Ion SCHEMBL17581846 | 0.99 | HSP90AA1 (0.95) | HSP90AA1TDP1TKTKDM4ELMNA | |
| Thiamine Ion SCHEMBL2269961 | 0.99 | HSP90AA1 (0.95) | HSP90AA1TDP1TKTKDM4ELMNA | |
| Thiamine Ion SCHEMBL27955189 | 0.99 | HSP90AA1 (1.00) | HSP90AA1TDP1TKTKDM4ELMNA | |
| Thiamine Ion SCHEMBL10075 | 0.99 | HSP90AA1 (1.00) | HSP90AA1TDP1TKTKDM4ELMNA | |
| Thiamine Ion SCHEMBL29361686 | 0.99 | HSP90AA1 (1.00) | HSP90AA1TDP1TKTKDM4ELMNA | |
| Thiamine Ion SCHEMBL18167436 | 0.98 | HSP90AA1 (0.93) | HSP90AA1TDP1TKTKDM4ELMNA | |
| Thiamine Ion SCHEMBL17747425 | 0.98 | HSP90AA1 (0.93) | HSP90AA1TDP1TKTKDM4ELMNA | |
| Thiamine Ion SCHEMBL18879464 | 0.98 | HSP90AA1 (0.93) | HSP90AA1TDP1TKTKDM4ELMNA | |
| Thiamine Ion SCHEMBL28182072 | 0.98 | HSP90AA1 (0.93) | HSP90AA1TDP1TKTKDM4ELMNA |
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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024133074-A1 | ASSOCIATION OF VITAMINS B1, B6 AND B9 VIA THE TOPICAL ROUTE | L'OREAL (FR) | 2024-06-27 | — | — | WO | claimed |
| CN-101095652-B | Hair care shampoo for increasing color brightness and color freshness of dyed keratin fibers | BEIERSDORF AG | 2011-04-06 | — | — | CN | claimed |
| CN-101095652-A | Hair care shampoo for increasing color brightness and color freshness of dyed keratin fibers | BEIERSDORF AG (DE) | 2008-01-02 | — | — | CN | claimed |
| WO-2024133074-A1 | ASSOCIATION OF VITAMINS B1, B6 AND B9 VIA THE TOPICAL ROUTE | L'OREAL (FR) | 2024-06-27 | — | — | WO | disclosed |
| CN-103843106-B | Utilize method and the evaporation suppression compositions of electron microscope observation Biosample | 独立行政法人科学技术振兴机构 | 2016-12-07 | — | — | CN | disclosed |
| EP-2476425-B1 | Composition comprising OPC and Omega-3 for preventing and/or inhibiting the development of diabetic retinopathy | VISIOTACT PHARMA (FR) | 2014-03-19 | — | — | EP | disclosed |
| WO-2014016627-A1 | VITAMIN AND MINERAL PREPARATIONS FOR GRAVIDAE FOR USE IN TRIMESTERS OF PREGNANCY | BABY-MED PROFESSIONAL COMPANY (HU) | 2014-01-30 | — | — | WO | disclosed |
| EP-2663319-A1 | COMPOSITION COMPRISING OPC AND OMEGA-3 FOR PREVENTING AND/OR INHIBITING THE DEVELOPMENT OF DIABETIC RETINOPATHY | Visiotact Pharma (FR) | 2013-11-20 | — | — | EP | disclosed |
| US-20130295199-A1 | Composition Comprising OPC and Omega-3 for Preventing and/or Inhibiting the Development of Diabetic Retinopathy | VISIOTACT PHARMA (FR) | 2013-11-07 | — | — | US | disclosed |
| WO-2012095525-A1 | COMPOSITION COMPRISING OPC AND OMEGA-3 FOR PREVENTING AND/OR INHIBITING THE DEVELOPMENT OF DIABETIC RETINOPATHY | VISIOTACT PHARMA (FR) | 2012-07-19 | — | — | WO | disclosed |
| EP-2476425-A1 | Composition comprising OPC and Omega-3 for preventing and/or inhibiting the development of diabetic retinopathy | Visiotact Pharma (FR) | 2012-07-18 | — | — | EP | disclosed |
| CN-1098642-C | Enhanced confectionery delivery system and method of making same | BRISTOL MYERS SQUIBB CO (US) | 2003-01-15 | — | — | CN | disclosed |
| US-20020025360-A1 | FORTIFIED CONFECTIONERY DELIVERY SYSTEMS AND METHODS OF PREPARATION THEREOF | CITY NATIONAL BANK, AS ADMINISTRATIVE AGENT | 2002-02-28 | — | — | US | disclosed |
| EP-0966208-A4 | FORTIFIED CONFECTIONERY DELIVERY SYSTEMS AND METHODS OF PREPARATION THEREOF | BRISTOL MYERS SQUIBB CO (US) | 2000-04-26 | — | — | EP | disclosed |
| CN-1251022-A | Fortified confectionery delivery systems and methods of prepn. thereof | BRISTOL MYERS SQUIBB CO (US) | 2000-04-19 | — | — | CN | disclosed |
| EP-0966208-A1 | FORTIFIED CONFECTIONERY DELIVERY SYSTEMS AND METHODS OF PREPARATION THEREOF | BRISTOL-MYERS SQUIBB COMPANY (US) | 1999-12-29 | — | — | EP | disclosed |
| WO-1999026491-A1 | FORTIFIED CONFECTIONERY DELIVERY SYSTEMS AND METHODS OF PREPARATION THEREOF | BRISTOL-MYERS SQUIBB COMPANY (US) | 1999-06-03 | — | — | WO | disclosed |
| US-5648231-A | ANIMAL FEEDS | DUCOA, L.P. (US) | 1997-07-15 | — | — | US | disclosed |
| EP-0642663-A1 | MEASUREMENT OF MOLD GROWTH ON POULTRY FEED | DUCOA L.P. (US) | 1995-03-15 | — | — | EP | disclosed |
| WO-1993024835-A1 | MEASUREMENT OF MOLD GROWTH ON AMORPHOUS SUBSTRATES | DUCOA L.P. (US) | 1993-12-09 | — | — | WO | disclosed |