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.
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 | |
|---|---|---|---|---|
| SCHEMBL4457 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL360707 | 0.94 | — | — | |
| Ammonia Solution, Strong SCHEMBL15169416 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL5960465 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL5960464 | 0.94 | HSP90AA1 (0.35) | — | |
| Phosphine SCHEMBL28646269 | 0.94 | — | — | |
| Fluoride SCHEMBL27615783 | 0.94 | — | — | |
| Benzene SCHEMBL28241501 | 0.92 | NOS2 (0.35) | — | |
| Formaldehyde SCHEMBL3745727 | 0.90 | — | — | |
| SCHEMBL28245321 | 0.90 | NOS2 (0.33) | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1130354-C | method and apparatus for melamine production | EUROTECNICA GROUP S A SWISS BR (CH) | 2003-12-10 | — | — | CN | claimed |
| CN-109761922-A | Pass through the improved method and relevant apparatus of the pyrolysis production high-purity melamine of urea | 欧洲技术设于伊特根的三聚氰氨，卢森堡，分支机构 | 2019-05-17 | — | — | CN | disclosed |
| CN-108602784-A | Method for revamping a high-pressure melamine plant | 卡萨勒有限公司 | 2018-09-28 | — | — | CN | disclosed |
| CN-106349174-A | Method for producing melamine and separating and recovering high-purity CO 2 and NH 3 | 欧洲技术设于伊特根的三聚氰氨, 卢森堡, 分支机构 | 2017-01-25 | — | — | CN | disclosed |
| EP-2601179-B1 | PROCESS FOR PREPARING AMINOTRIAZINE ALKOXYLATES | BASF SE (DE) | 2016-10-19 | — | — | EP | disclosed |
| CN-102850286-B | Process for the production of high purity melamine from urea | UREA CASALE SA | 2015-01-14 | — | — | CN | disclosed |
| CN-101959869-B | Process for the production of high-purity melamine from urea | UREA CASALE SA | 2013-03-27 | — | — | CN | disclosed |
| CN-102850286-A | Process for the production of high purity melamine from urea | UREA CASALE SA | 2013-01-02 | — | — | CN | disclosed |
| CN-101959869-A | Process for the production of high-purity melamine from urea | UREA CASALE SA | 2011-01-26 | — | — | CN | disclosed |
| CN-100381367-C | Thermal water treatment device and method | AMI AGROLINZ MELAMINE INT GMBH (AT) | 2008-04-16 | — | — | CN | disclosed |
| CN-1300122-C | Process for the production of melamine from urea, in particular for obtaining melamine-free off-gas in the first separation step | EUROTECNICA GROUP S A (CH) | 2007-02-14 | — | — | CN | disclosed |
| CN-1662452-A | Thermal water treatment device and method | AMI AGROLINZ MELAMINE INT GMBH (AT) | 2005-08-31 | — | — | CN | disclosed |
| US-20040200993-A1 | Reactive liquid polymer crosslinking agent and process for preparation | LCB WORLDWIDE, INC. | 2004-10-14 | — | — | US | disclosed |
| CN-1130354-C | method and apparatus for melamine production | EUROTECNICA GROUP S A SWISS BR (CH) | 2003-12-10 | — | — | CN | disclosed |