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 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | NQO2 | P16083 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7122305 | 0.84 | — | — | |
| Sulfuric Acid SCHEMBL9614826 | 0.81 | MAPT (0.35) | ALDH1A1NQO2POLBKDM4EMAPT | |
| Sulfuric Acid SCHEMBL6683793 | 0.79 | MAPT (0.36) | ALDH1A1NQO2POLBKDM4EMAPT | |
| Water SCHEMBL11405638 | 0.78 | KDM4E (0.36) | NQO2KDM4EMAPTHPGDHSD17B10 | |
| SCHEMBL6535868 | 0.77 | LMNA (0.38) | ALDH1A1NQO2POLBKDM4EMAPT | |
| Water SCHEMBL11577661 | 0.70 | ALDH1A1 (0.42) | ALDH1A1POLBMAPT | |
| SCHEMBL8029824 | 0.69 | GAA (0.39) | ALDH1A1POLBMAPT | |
| Water SCHEMBL11206302 | 0.67 | MAPT (0.41) | ALDH1A1POLBMAPTHSD17B10 | |
| SCHEMBL7521178 | 0.66 | MAPT (0.40) | ALDH1A1POLBKDM4EMAPTHPGD | |
| Sulfuric Acid SCHEMBL9327543 | 0.66 | NQO2 (0.40) | ALDH1A1NQO2POLBKDM4EMAPT |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0602742-A2 | Photographic material and process employing a development inhibitor releasing compound containing a fluorinated carbon alpha to an amide group | EASTMAN KODAK COMPANY (US) | 1994-06-22 | — | — | EP | disclosed |
| US-5283163-A | Color photography; sharpness; good interimage results; quality | EASTMAN KODAK COMPANY (US) | 1994-02-01 | — | — | US | disclosed |
| US-5242783-A | Photographic films with ketocarbonyls | EASTMAN KODAK COMPANY (US) | 1993-09-07 | — | — | US | disclosed |
| EP-0551509-A1 | PHOTOGRAPHIC MATERIAL AND PROCESS | EASTMAN KODAK COMPANY (US) | 1993-07-21 | — | — | EP | disclosed |
| WO-1993003419-A1 | PHOTOGRAPHIC MATERIAL AND PROCESS | EASTMAN KODAK COMPANY (US) | 1993-02-18 | — | — | WO | disclosed |