Known targets — ChEMBL curated mechanism
ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Dodecanoate. 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 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.49 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.48 |
| ▸ | DGKA | P23743 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 2/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | FABP3 | P05413 | 5/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Stearic Acid SCHEMBL2935724 | 0.89 | MEN1 (0.52) | KDM4EDUSP3MEN1KMT2ALMNA | |
| Dodecanoate SCHEMBL6416181 | 0.89 | MEN1 (0.52) | KDM4EDUSP3MEN1KMT2ALMNA | |
| Dodecanoate SCHEMBL5463543 | 0.85 | NFKB1 (0.57) | KDM4EDUSP3MEN1KMT2ALMNA | |
| Dodecanoate SCHEMBL327165 | 0.82 | NFKB1 (0.57) | KDM4EDUSP3MEN1KMT2ALMNA | |
| Stearic Acid SCHEMBL11276581 | 0.82 | NFKB1 (0.57) | KDM4EDUSP3MEN1KMT2ALMNA | |
| Stearic Acid SCHEMBL6911083 | 0.82 | NFKB1 (0.65) | KDM4EDUSP3MEN1KMT2ALMNA | |
| Octanoic Acid SCHEMBL17395727 | 0.82 | NFKB1 (0.65) | KDM4EDUSP3MEN1KMT2ALMNA | |
| Dodecanoate SCHEMBL11277766 | 0.82 | NFKB1 (0.65) | KDM4EDUSP3MEN1KMT2ALMNA | |
| Dodecanoate SCHEMBL27610497 | 0.82 | NFKB1 (0.65) | KDM4EDUSP3MEN1KMT2ALMNA | |
| Palmitic Acid SCHEMBL11280216 | 0.82 | NFKB1 (0.65) | KDM4EDUSP3MEN1KMT2ALMNA |
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-6914088-B2 | DIACETAL COMPOSITION, POLYOLEFIN NUCLEATING AGENT COMPRISING THE DIACETAL COMPOSITION, POLYOLEFIN RESIN COMPOSITIONS CONTAINING THE DIACETAL COMPOSITION, METHOD FOR MANUFACTURING THE RESIN COMPOSITION, AND MOLDINGS | NEW JAPAN CHEMICAL CO., LTD. (JP) | 2005-07-05 | — | — | US | disclosed |
| US-6602848-B2 | Contains alkali metal N-methyltaurate, alkali metal taurate or alkali metal hypotaurate salt of specific organic acid or organic alkali N-methyltaurate, organic alkali taurate or organic alkali hypotaurate salt of specific organic acid | SHISEIDO COMPANY, LTD. (JP) | 2003-08-05 | — | — | US | disclosed |
| US-20030109610-A1 | Diacetal composition, polyolefin nucleating agent comprising the diacetal composition, polyolefin resin compositions containing the diacetal composition, method for manufacturing the resin composition, and moldings | NEW JAPAN CHEMICAL CO., LTD (JP) | 2003-06-12 | — | — | US | disclosed |
| US-6355608-B1 | DETERGENT COMPOSITION COMPRISING AQUEOUS SOLUTION OF ALKALI METAL N-METHYLTAURATE SALT OF FATTY ACID, IN CONCENTRATION OF AT LEAST 50 MOLE PERCENT BASED ON TOTAL MOLES OF ALKALI METAL SALT OF FATTY ACID PRESENT | SHISEIDO CO., LTD. (JP) | 2002-03-12 | — | — | US | disclosed |
| US-6344435-B1 | Detergent composition | SHISEIDO CO., LTD. (JP) | 2002-02-05 | — | — | US | disclosed |