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 | |
|---|---|---|---|---|
| ▸ | THRB known ✓ | P10828 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.73 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.73 |
| ▸ | APP | P05067 | 1/20 | 0.71 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.61 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | PTPRA | P18433 | 1/20 | 0.61 |
| ▸ | PTPRB | P23467 | 1/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.61 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.61 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.53 |
| ▸ | DUSP5 | Q16690 | 2/20 | 0.53 |
| ▸ | DNASE1L3 | Q13609 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL29421649 | 1.00 | MAPK1 (0.73) | MAPK1ALDH1A1APPCYP1A2HIF1A | |
| SCHEMBL1638375 | 1.00 | MAPK1 (0.73) | MAPK1ALDH1A1APPCYP1A2HIF1A | |
| SCHEMBL93701 | 0.90 | APP (0.72) | MAPK1ALDH1A1APPCYP1A2HIF1A | |
| SCHEMBL93700 | 0.90 | APP (0.72) | MAPK1ALDH1A1APPCYP1A2HIF1A | |
| SCHEMBL29353967 | 0.90 | APP (0.72) | MAPK1ALDH1A1APPCYP1A2HIF1A | |
| SCHEMBL29912825 | 0.88 | APP (0.69) | MAPK1ALDH1A1APPCYP1A2HIF1A | |
| SCHEMBL10621065 | 0.84 | MAPK1 (1.00) | MAPK1ALDH1A1APPCYP1A2HIF1A | |
| SCHEMBL1098204 | 0.84 | MAPK1 (1.00) | MAPK1ALDH1A1APPCYP1A2HIF1A | |
| SCHEMBL1098207 | 0.84 | MAPK1 (1.00) | MAPK1ALDH1A1APPCYP1A2HIF1A | |
| SCHEMBL10621049 | 0.83 | MAPK1 (0.98) | MAPK1ALDH1A1APPCYP1A2HIF1A |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112384225-A | Application of edible azo dye brilliant black BN in inhibiting infectivity of human enteroviruses causing hand-foot-and-mouth disease | 淡马锡生命科学实验室有限公司 | 2021-02-19 | — | — | CN | claimed |
| WO-2019216829-A1 | APPLICATION OF A FOOD AZO DYE, BRILLIANT BLACK BN, ON INHIBITION OF INFECTIVITY OF HUMAN ENTEROVIRUSES CAUSING HAND FOOT AND MOUTH DISEASES | TEMASEK LIFE SCIENCES LABORATORY LIMITED (SG) | 2019-11-14 | — | — | WO | claimed |
| CN-112384225-A | Application of edible azo dye brilliant black BN in inhibiting infectivity of human enteroviruses causing hand-foot-and-mouth disease | 淡马锡生命科学实验室有限公司 | 2021-02-19 | — | — | CN | disclosed |
| US-4784959-A | Method of detecting hydrocarbon fuel leaks | LOCKHEED CORPORATION (US) | 1988-11-15 | — | — | US | disclosed |
| US-4756854-A | Method and apparatus for detecting hydrocarbon fuel leaks | LOCKHEED CORPORATION (US) | 1988-07-12 | — | — | US | disclosed |
| US-4745797-A | Method and apparatus for detecting hydrocarbon fuel leaks | LOCKHEED CORPORATION (US) | 1988-05-24 | — | — | US | disclosed |
| US-4615828-A | Method and apparatus for detecting hydrocarbon fuel leaks | LOCKHEED CORPORATION (US) | 1986-10-07 | — | — | US | disclosed |