Known targets — ChEMBL curated mechanism
ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO
The experimentally established mechanism targets of Water. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRBN known ✓ | Q96SW2 | 1/20 | 0.35 |
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 4/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.44 |
| ▸ | BLM | P54132 | 2/20 | 0.44 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | THPO | P40225 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CA5A | P35218 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL33749 | 0.96 | LMNA (0.47) | LMNATSHRNFKB1BLMPMP22 | |
| SCHEMBL27913402 | 0.92 | LMNA (0.44) | LMNATSHRNFKB1BLMPMP22 | |
| Hydrochloric Acid SCHEMBL28091299 | 0.92 | LMNA (0.50) | LMNATSHRNFKB1BLMPMP22 | |
| SCHEMBL3773719 | 0.92 | LMNA (0.44) | LMNATSHRNFKB1BLMPMP22 | |
| SCHEMBL28009309 | 0.81 | LMNA (0.41) | LMNATSHRNFKB1BLMPMP22 | |
| SCHEMBL27709209 | 0.79 | — | — | |
| Water SCHEMBL27424675 | 0.74 | — | — | |
| SCHEMBL8761075 | 0.74 | — | — | |
| SCHEMBL5409424 | 0.72 | — | — | |
| SCHEMBL21801991 | 0.72 | — | — |
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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0996701-B1 | BLEACH COMPATIBLE ALKOXYLATED POLYALKYLENEIMINES | PROCTER & GAMBLE (US) | 2004-03-24 | — | — | EP | claimed |
| US-6075000-A | Bleach compatible alkoxylated polyalkyleneimines | THE PROCTER & GAMBLE COMPANY (US) | 2000-06-13 | — | — | US | claimed |
| EP-0996701-A1 | BLEACH COMPATIBLE ALKOXYLATED POLYALKYLENEIMINES | THE PROCTER & GAMBLE COMPANY (US) | 2000-05-03 | — | — | EP | claimed |
| EP-0918837-A1 | LAUNDRY DETERGENT COMPOSITIONS AND METHODS FOR PROVIDING SOIL RELEASE TO COTTON FABRIC | THE PROCTER & GAMBLE COMPANY (US) | 1999-06-02 | — | — | EP | claimed |
| WO-1999001530-A1 | BLEACH COMPATIBLE ALKOXYLATED POLYALKYLENEIMINES | THE PROCTER & GAMBLE COMPANY (US) | 1999-01-14 | — | — | WO | claimed |
| WO-1997042288-A1 | LAUNDRY DETERGENT COMPOSITIONS AND METHODS FOR PROVIDING SOIL RELEASE TO COTTON FABRIC | THE PROCTER & GAMBLE COMPANY (US) | 1997-11-13 | — | — | WO | claimed |
| CN-107858218-A | Capsule and the composition for including it | 美利肯公司 | 2018-03-30 | — | — | CN | disclosed |
| CN-102906239-B | White dyes and containing its composition | MILLIKEN & CO. (US) | 2015-09-09 | — | — | CN | disclosed |
| CN-102906200-B | Optical brighteners and compositions comprising the same | MILLIKEN & CO | 2015-01-07 | — | — | CN | disclosed |
| CN-102918120-B | Coloured particles with delayed release properties | MILLIKEN & CO | 2014-08-13 | — | — | CN | disclosed |
| CN-103492062-A | Capsules and compositions comprising same | MILLIKEN & CO | 2014-01-01 | — | — | CN | disclosed |
| CN-102918120-A | Coloured particles with delayed release properties | MILLIKEN & CO | 2013-02-06 | — | — | CN | disclosed |
| CN-102906200-A | Optical brighteners and compositions comprising the same | MILLIKEN & CO | 2013-01-30 | — | — | CN | disclosed |
| EP-0996701-A1 | BLEACH COMPATIBLE ALKOXYLATED POLYALKYLENEIMINES | THE PROCTER & GAMBLE COMPANY (US) | 2000-05-03 | — | — | EP | disclosed |
| US-5968893-A | RELEASE AGENTS FOR SOILS IN FABRICS | THE PROCTER & GAMBLE COMPANY (US) | 1999-10-19 | — | — | US | disclosed |
| WO-1999042551-A1 | BLEACH DETERGENT COMPOSITIONS CONTAINING MODIFIED POLYAMINE POLYMERS | THE PROCTER & GAMBLE COMPANY (US) | 1999-08-26 | — | — | WO | disclosed |
| CN-1222932-A | Use of anionic gemini surfactants in formulations of detergents, cleaning agents and skin-care agents | RWE DEA PETROCHEMICAL CO LTD (DE) | 1999-07-14 | — | — | CN | disclosed |
| WO-1999001530-A1 | BLEACH COMPATIBLE ALKOXYLATED POLYALKYLENEIMINES | THE PROCTER & GAMBLE COMPANY (US) | 1999-01-14 | — | — | WO | disclosed |
| US-5405412-A | Laundry detergent, automatic dishwashing compound | THE PROCTER & GAMBLE COMPANY (US) | 1995-04-11 | — | — | US | disclosed |
| CN-1090880-A | The clean-out system that contains low foamy polyhydroxy fatty acid amide nonionic/anionic surfactant mixture | PROCTER & GAMBLE (US) | 1994-08-17 | — | — | CN | disclosed |