Known targets — ChEMBL curated mechanism
ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO
The experimentally established mechanism targets of Tributylmethylammonium. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A1 | O15245 | 3/20 | 0.53 |
| ▸ | DNM1 | Q05193 | 8/20 | 0.50 |
| ▸ | APAF1 | O14727 | 1/20 | 0.48 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.48 |
| ▸ | RAD52 | P43351 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.44 |
| ▸ | LSS | P48449 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Tributylmethylammonium SCHEMBL8961295 | 0.97 | APAF1 (0.52) | SLC22A1DNM1APAF1HSP90AA1RAD52 | |
| Tributylmethylammonium SCHEMBL93610 | 0.96 | SLC22A1 (0.56) | SLC22A1DNM1HTTSLC22A2LSS | |
| Tributylmethylammonium SCHEMBL29403115 | 0.93 | SLC22A1 (0.53) | SLC22A1DNM1HTTSLC22A2LSS | |
| Tributylmethylammonium SCHEMBL4617487 | 0.93 | SLC22A1 (0.53) | SLC22A1DNM1HTTSLC22A2LSS | |
| Tributylmethylammonium SCHEMBL165919 | 0.93 | SLC22A1 (0.53) | SLC22A1DNM1HSP90AA1RAD52HTT | |
| Tributylmethylammonium SCHEMBL125277 | 0.93 | SLC22A1 (0.53) | SLC22A1DNM1APAF1HSP90AA1RAD52 | |
| Tributylmethylammonium SCHEMBL239485 | 0.93 | SLC22A1 (0.53) | SLC22A1DNM1HTTSLC22A2LSS | |
| Tributylmethylammonium SCHEMBL238424 | 0.93 | DNM1 (0.55) | SLC22A1DNM1HSP90AA1RAD52HTT | |
| Tributylmethylammonium SCHEMBL3321318 | 0.93 | SLC22A1 (0.53) | SLC22A1DNM1HTTSLC22A2LSS | |
| Tributylmethylammonium SCHEMBL16028454 | 0.93 | SLC22A1 (0.53) | SLC22A1DNM1HTTSLC22A2LSS |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023106194-A1 | COMPOSITE METAL ACID COMPOUND DISPERSION SOLUTION, COMPOSITE METAL ACID COMPOUND POWDER, COMPOSITE METAL ACID COMPOUND FILM, AND METHODS RESPECTIVELY FOR PRODUCING THOSE PRODUCTS | 三井金属鉱業株式会社 | 2023-06-15 | — | — | WO | disclosed |
| WO-2023106193-A1 | COMPOSITE METAL OXIDE COMPOUND | 三井金属鉱業株式会社 | 2023-06-15 | — | — | WO | disclosed |
| WO-2020009225-A1 | MEMBER, CONTAINER, MEDICINAL-SOLUTION-ACCOMMODATING BODY, REACTION VESSEL, DISTILLATION COLUMN, FILTER UNIT, RESERVOIR TANK, PIPING, AND METHOD FOR PRODUCING MEDICINAL SOLUTION | 富士フイルム株式会社 | 2020-01-09 | — | — | WO | disclosed |
| WO-2019187868-A1 | TREATMENT FLUID | 富士フイルム株式会社 | 2019-10-03 | — | — | WO | disclosed |