Known targets — ChEMBL curated mechanism
ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of None. 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 | |
|---|---|---|---|---|
| Potassium Ion SCHEMBL7571421 | 0.95 | — | — | |
| Lithium Ion SCHEMBL7569258 | 0.95 | — | — | |
| SCHEMBL8328392 | 0.91 | ACHE (0.45) | — | |
| SCHEMBL8332944 | 0.91 | ACHE (0.45) | — | |
| SCHEMBL8332956 | 0.91 | ACHE (0.45) | — | |
| Tetramethylammonium Ion SCHEMBL8330660 | 0.91 | ACHE (0.45) | — | |
| Tetrabuthylammonium SCHEMBL8330747 | 0.81 | SLC22A1 (0.41) | — | |
| Tetrabuthylammonium SCHEMBL8520961 | 0.76 | SLC22A1 (0.36) | — | |
| SCHEMBL5349960 | 0.73 | — | — | |
| SCHEMBL6486 | 0.72 | ACHE (0.54) | — |
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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0948326-B1 | METHOD FOR PREPARING CYANOPHOSPHONATE DERIVATIVES FROM PHOSPHORIC ANHYDRIDE AND CYANIDE | MONSANTO TECHNOLOGY LLC (US) | 2002-09-18 | — | — | EP | claimed |
| JP-2001508428-A | — | — | 2001-06-26 | — | — | JP | claimed |
| JP-2001507664-A | — | — | 2001-06-12 | — | — | JP | claimed |
| JP-2001507695-A | — | — | 2001-06-12 | — | — | JP | claimed |
| EP-0948507-A1 | HYDROGENATION OF CYANOPHOSPHONATE DERIVATIVES | MONSANTO COMPANY (US) | 1999-10-13 | — | — | EP | claimed |
| EP-0948504-A1 | PREPARATION OF CYANOPHOSPHONATES FROM PYROPHOSPHATES AND CYANIDE | MONSANTO COMPANY (US) | 1999-10-13 | — | — | EP | claimed |
| EP-0948506-A1 | CYANOPHOSPHONATE DERIVATIVES | MONSANTO COMPANY (US) | 1999-10-13 | — | — | EP | claimed |
| EP-0948326-A2 | METHOD FOR PREPARING CYANOPHOSPHONATE DERIVATIVES FROM PHOSPHORIC ANHYDRIDE AND CYANIDE | MONSANTO COMPANY (US) | 1999-10-13 | — | — | EP | claimed |
| US-5935542-A | Cyanphosphonate derivatives and method for their preparation | MONSANTO COMPANY (US) | 1999-08-10 | — | — | US | claimed |
| US-5905163-A | REDUCTION OF CYANO GROUP BY CATALYTIC HYDROGENATION | MONSANTO COMPANY (US) | 1999-05-18 | — | — | US | claimed |
| US-5859278-A | Method for preparing cyanophosphonate derivatives from pyrophosphate or polyphosphate esters and cyanide | MONSANTO COMPANY (US) | 1999-01-12 | — | — | US | claimed |
| US-5858317-A | Method for preparing cyanophosphonate derivatives from phosphoric anhydride and cyanide | MONSANTO COMPANY (US) | 1999-01-12 | — | — | US | claimed |
| WO-1998029106-A9 | METHOD FOR PREPARING CYANOPHOSPHONATE DERIVATIVES FROM PHOSPHORIC ANHYDRIDE AND CYANIDE | — | 1998-12-23 | — | — | WO | claimed |
| WO-1998029422-A1 | CYANOPHOSPHONATE DERIVATIVES | MONSANTO COMPANY (US) | 1998-07-09 | — | — | WO | claimed |
| WO-1998029420-A1 | PREPARATION OF CYANOPHOSPHONATES FROM PYROPHOSPHATES AND CYANIDE | MONSANTO COMPANY (US) | 1998-07-09 | — | — | WO | claimed |
| WO-1998029423-A1 | HYDROGENATION OF CYANOPHOSPHONATE DERIVATIVES | MONSANTO COMPANY (US) | 1998-07-09 | — | — | WO | claimed |
| WO-1998029106-A2 | METHOD FOR PREPARING CYANOPHOSPHONATE DERIVATIVES FROM PHOSPHORIC ANHYDRIDE AND CYANIDE | MONSANTO COMPANY (US) | 1998-07-09 | — | — | WO | claimed |
| EP-0948326-B1 | METHOD FOR PREPARING CYANOPHOSPHONATE DERIVATIVES FROM PHOSPHORIC ANHYDRIDE AND CYANIDE | MONSANTO TECHNOLOGY LLC (US) | 2002-09-18 | — | — | EP | disclosed |
| WO-1998029422-A1 | CYANOPHOSPHONATE DERIVATIVES | MONSANTO COMPANY (US) | 1998-07-09 | — | — | WO | disclosed |
| WO-1998029106-A2 | METHOD FOR PREPARING CYANOPHOSPHONATE DERIVATIVES FROM PHOSPHORIC ANHYDRIDE AND CYANIDE | MONSANTO COMPANY (US) | 1998-07-09 | — | — | WO | disclosed |