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 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 known ✓ | P00915 | 1/20 | 0.33 |
| ▸ | CA2 known ✓ | P00918 | 1/20 | 0.33 |
| ▸ | CA12 known ✓ | O43570 | 1/20 | 0.32 |
| ▸ | MMP1 | P03956 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | MMP3 | P08254 | 1/20 | 0.36 |
| ▸ | PKLR | P30613 | 2/20 | 0.34 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.32 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10384961 | 0.85 | CYP1A2 (0.43) | MMP1MMP2MMP3BCAT2CYP1A2 | |
| SCHEMBL29406060 | 0.80 | MMP1 (0.37) | MMP1MMP2MMP3PKLRALDH1A1 | |
| SCHEMBL219767 | 0.80 | MMP1 (0.37) | MMP1MMP2MMP3PKLRALDH1A1 | |
| SCHEMBL9244823 | 0.79 | NFKB1 (0.41) | CA9NPC1ALDH1A1HPGDSMN1; SMN2 | |
| Potassium Ion SCHEMBL5180511 | 0.77 | MMP1 (0.37) | MMP1MMP2MMP3CYP1A2ALDH1A1 | |
| SCHEMBL29210006 | 0.77 | ELANE (0.42) | PKLRL3MBTL1CA9SMN1; SMN2CA1 | |
| SCHEMBL6056924 | 0.73 | TSHR (0.52) | L3MBTL1NPC1ALDH1A1HPGDRAB9A | |
| SCHEMBL10504180 | 0.72 | TSHR (0.50) | L3MBTL1NPC1ALDH1A1HPGDRAB9A | |
| SCHEMBL38664384 | 0.71 | BCAT2 (0.42) | MMP1MMP2PKLRBCAT2L3MBTL1 | |
| SCHEMBL10497327 | 0.71 | MMP1 (0.40) | MMP1MMP2MMP3CYP1A2NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-10774290-B2 | Detergent composition in the form of an effervescent tablet | Coma, Lorena Martí (ES) | 2020-09-15 | — | — | US | disclosed |
| CN-107614670-B | Detergent composition in the form of effervescent tablets | 洛雷纳·马提柯马 | 2020-09-01 | — | — | CN | disclosed |
| EP-3299446-B1 | DETERGENT COMPOSITION IN THE FORM OF AN EFFERVESCENT TABLET | MARTI COMA LORENA (ES) | 2020-05-06 | — | — | EP | disclosed |
| US-20180105766-A1 | DETERGENT COMPOSITION IN THE FORM OF AN EFFERVESCENT TABLET | MARTÍ COMA, Lorena (ES) | 2018-04-19 | — | — | US | disclosed |
| EP-3299446-A1 | DETERGENT COMPOSITION IN THE FORM OF AN EFFERVESCENT TABLET | Martí Coma, Lorena (ES) | 2018-03-28 | — | — | EP | disclosed |