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.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 known ✓ | O43570 | 1/20 | 0.39 |
| ▸ | CA1 known ✓ | P00915 | 1/20 | 0.39 |
| ▸ | CA2 known ✓ | P00918 | 1/20 | 0.39 |
| ▸ | XDH known ✓ | P47989 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | F11 | P03951 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11680920 | 0.85 | MAPT (0.66) | MAPTRAB9ACA1CA2KDM4E | |
| SCHEMBL10661666 | 0.85 | MAPT (0.47) | MAPTPLA2G2ARAB9AATMCA12 | |
| SCHEMBL8746147 | 0.84 | PLA2G2A (0.53) | PLA2G2ATDP1L3MBTL1ALDH1A1MEN1 | |
| SCHEMBL2470423 | 0.84 | MAPT (0.46) | MAPTPLA2G2ARAB9AATMCA12 | |
| SCHEMBL8959009 | 0.83 | PLA2G2A (0.41) | PLA2G2ACA1CA2F11LMNA | |
| SCHEMBL89250 | 0.78 | MAPT (0.53) | MAPTPLA2G2ARAB9AATMCA12 | |
| SCHEMBL2771698 | 0.78 | MAPT (0.58) | MAPTPLA2G2ARAB9AKDM4EL3MBTL1 | |
| SCHEMBL4727665 | 0.76 | MAPT (0.51) | MAPTPLA2G2ARAB9AATMCA12 | |
| SCHEMBL17413301 | 0.76 | PLA2G2A (0.63) | MAPTPLA2G2A | |
| SCHEMBL5550560 | 0.76 | MAPT (0.55) | MAPTPLA2G2ARAB9AATMCA12 |
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-1664152-B1 | IONOMERIC OXYGEN SCAVENGER COMPOSITIONS | CRYOVAC INC (US) | 2011-10-05 | — | — | EP | disclosed |
| EP-1664152-A2 | IONOMERIC OXYGEN SCAVENGER COMPOSITIONS | Cryovac, Inc. (US) | 2006-06-07 | — | — | EP | disclosed |
| US-6872451-B2 | Ionomeric oxygen scavenger compositions | CRYOVAC, INC. (US) | 2005-03-29 | — | — | US | disclosed |
| WO-2005023674-A2 | IONOMERIC OXYGEN SCAVENGER COMPOSITIONS | CRYOVAC, INC. (US) | 2005-03-17 | — | — | WO | disclosed |
| US-20050048286-A1 | IONOMERIC OXYGEN SCAVENGER COMPOSITIONS | CRYOVAC, INC. | 2005-03-03 | — | — | US | disclosed |