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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 known ✓ | P00915 | 1/20 | 0.41 |
| ▸ | CA2 known ✓ | P00918 | 1/20 | 0.41 |
| ▸ | MGLL | Q99685 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.42 |
| ▸ | EIF4H | Q15056 | 1/20 | 0.42 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18631331 | 0.88 | TSHR (0.50) | MGLLTSHRCA1CA2CA9 | |
| SCHEMBL4444788 | 0.85 | MGLL (0.43) | MGLLL3MBTL1TDP1CA2 | |
| SCHEMBL4438964 | 0.85 | CA1 (0.45) | MGLLPABPC1EIF4HCTDSP1CA1 | |
| SCHEMBL4434540 | 0.85 | MEN1 (0.45) | CA2HRH3 | |
| SCHEMBL23461595 | 0.85 | TSHR (0.47) | MGLLTSHRCA1CA2CA9 | |
| SCHEMBL6598977 | 0.81 | MGLL (0.49) | MGLLTSHRL3MBTL1TDP1CA1 | |
| SCHEMBL31061188 | 0.80 | MGLL (0.48) | MGLLTSHRL3MBTL1TDP1CA1 | |
| SCHEMBL22071071 | 0.80 | CA2 (0.49) | MGLLTSHRL3MBTL1TDP1CA1 | |
| SCHEMBL22070850 | 0.80 | MGLL (0.48) | MGLLTSHRL3MBTL1TDP1CA1 | |
| SCHEMBL4435889 | 0.80 | MGLL (0.48) | MGLLTSHRL3MBTL1TDP1CA1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101600823-A | Wettable polyester fibers and fabric | CIBA HOLDING INC (CH) | 2009-12-09 | — | — | CN | disclosed |
| EP-2122020-A1 | WETTABLE POLYESTER FIBERS AND FABRICS | Ciba Holding Inc. (CH) | 2009-11-25 | — | — | EP | disclosed |
| WO-2008090060-A1 | WETTABLE POLYESTER FIBERS AND FABRICS | CIBA HOLDING INC. (CH) | 2008-07-31 | — | — | WO | disclosed |
| US-20080176475-A1 | Wettable polyester fibers and fabrics | CIBA CORP. | 2008-07-24 | — | — | US | disclosed |