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 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 known ✓ | O43570 | 7/20 | 0.61 |
| ▸ | CA2 known ✓ | P00918 | 7/20 | 0.61 |
| ▸ | CA1 known ✓ | P00915 | 6/20 | 0.61 |
| ▸ | CA9 | Q16790 | 7/20 | 0.61 |
| ▸ | MAOA | P21397 | 3/20 | 0.52 |
| ▸ | MAOB | P27338 | 3/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.50 |
| ▸ | HTR2A | P28223 | 1/20 | 0.50 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | NOS1 | P29475 | 1/20 | 0.48 |
| ▸ | HTR3A | P46098 | 1/20 | 0.48 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Potassium Ion SCHEMBL23878393 | 0.98 | CA12 (0.59) | CA12CA2CA9CA1MAOA | |
| SCHEMBL23878481 | 0.98 | CA12 (0.59) | CA12CA2CA9CA1MAOA | |
| Zinc Ion SCHEMBL20601196 | 0.98 | CA12 (0.59) | CA12CA2CA9CA1MAOA | |
| SCHEMBL23878392 | 0.98 | CA12 (0.59) | CA12CA2CA9CA1MAOA | |
| SCHEMBL10597986 | 0.87 | MAOA (0.54) | CA12CA2CA9CA1MAOA | |
| SCHEMBL27621139 | 0.87 | CA12 (0.53) | CA12CA2CA9CA1MAOA | |
| SCHEMBL702198 | 0.85 | MAOA (0.52) | CA12CA2CA9CA1MAOA | |
| Ammonia Solution, Strong SCHEMBL23878420 | 0.83 | MAOA (0.50) | CA12CA2CA9CA1MAOA | |
| SCHEMBL17685698 | 0.83 | MAOA (0.50) | CA12CA2CA9CA1MAOA | |
| SCHEMBL7889408 | 0.83 | MAOA (0.50) | CA12CA2CA9CA1MAOA |
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 76 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118294561-A | Method for measuring methanesulfonate in transdermal patch by derivatization HPLC-UV method | 上海世领制药有限公司 | 2024-07-05 | — | — | CN | claimed |
| EP-4130136-B1 | RUBBER COMPOSITION, VULCANIZED MATERIAL, AND MOLDED ARTICLE | DENKA COMPANY LTD (JP) | 2024-04-17 | — | — | EP | claimed |
| CN-117624824-A | Dry instant SBS asphalt modifier and preparation method thereof | 南京市路桥工程有限公司 | 2024-03-01 | — | — | CN | claimed |
| US-20230383082-A1 | RUBBER FOAM COMPOSITION, FOAM AND MOLDED ARTICLE | DENKA COMPANY LIMITED (JP) | 2023-11-30 | — | — | US | claimed |
| EP-4223787-A1 | RUBBER FOAM COMPOSITION, FOAM AND MOLDED ARTICLE | Denka Company Limited (JP) | 2023-08-09 | — | — | EP | claimed |
| EP-4130136-A1 | RUBBER COMPOSITION, VULCANIZED MATERIAL, AND MOLDED ARTICLE | Denka Company Limited (JP) | 2023-02-08 | — | — | EP | claimed |
| CN-114945246-A | Palladium removal process of circuit board, palladium passivator with non-metal holes and preparation method of palladium passivator | 深圳市松柏实业发展有限公司 | 2022-08-26 | — | — | CN | claimed |
| EP-3889189-B1 | SULFUR-MODIFIED CHLOROPRENE RUBBER AND METHOD FOR PRODUCING SAME, SULFUR-MODIFIED CHLOROPRENE RUBBER COMPOSITION, VULCANIZATE, AND MOLDED ARTICLE | DENKA COMPANY LTD (JP) | 2022-07-06 | — | — | EP | claimed |
| CN-111187193-B | Preparation method of rubber additive 1, 6-di (N, N-dibenzylcarbamyl disulfide) hexane | 山东阳谷华泰化工股份有限公司 | 2022-04-15 | — | — | CN | claimed |
| CN-114105904-A | Preparation method of rubber organic polysulfide | 蔚林新材料科技股份有限公司 | 2022-03-01 | — | — | CN | claimed |
| EP-3889187-A1 | SULFUR-MODIFIED CHLOROPRENE RUBBER, METHOD FOR PRODUCING SAME, SULFUR-MODIFIED CHLOROPRENE RUBBER COMPOSITION, VULCANIZED PRODUCT AND MOLDED ARTICLE | Denka Company Limited (JP) | 2021-10-06 | — | — | EP | claimed |
| EP-3889189-A1 | SULFUR-MODIFIED CHLOROPRENE RUBBER AND METHOD FOR PRODUCING SAME, SULFUR-MODIFIED CHLOROPRENE RUBBER COMPOSITION, VULCANIZATE, AND MOLDED ARTICLE | Denka Company Limited (JP) | 2021-10-06 | — | — | EP | claimed |
| CN-113444114-A | Application of copper dibenzyl dithiocarbamate medicament to treatment of triple negative breast cancer | 吴超君 | 2021-09-28 | — | — | CN | claimed |
| CN-113166300-A | Sulfur-modified chloroprene rubber and method for producing same, sulfur-modified chloroprene rubber composition, vulcanizate, and molded article | 电化株式会社 | 2021-07-23 | — | — | CN | claimed |
| CN-113166299-A | Sulfur-modified chloroprene rubber and method for producing same, sulfur-modified chloroprene rubber composition, vulcanizate, and molded article | 电化株式会社 | 2021-07-23 | — | — | CN | claimed |
| CN-112430204-A | 1, 6-bis (N, N' -dibenzyl thiocarbamoyl disulfide) hexane as anti-reversion agent and preparation method thereof | 江苏麒祥高新材料有限公司 | 2021-03-02 | — | — | CN | claimed |
| CN-111187193-A | Preparation method of rubber additive 1, 6-di (N, N-dibenzylcarbamyl disulfide) hexane | 山东阳谷华泰化工股份有限公司 | 2020-05-22 | — | — | CN | claimed |
| CN-110643411-A | Synthetic power engine oil reinforcing agent and preparation method thereof | 晋江市三豪汽车配件有限公司 | 2020-01-03 | — | — | CN | claimed |
| US-20070100042-A1 | Rubber composition and tire comprising same | MICHELIN RECHERCHE ET TECHNIQUE, S.A. (CH) | 2007-05-03 | — | — | US | claimed |
| US-6187829-B1 | FOAMABLE COMPOSITION; STORAGE STABILITY; BLEND OF RUBBER, VULCANIZING AGENT, AMMONIA, GELLING AGENT WHICH IS REACTION PRODUCT OF ZINC CHLORIDE AND AMMONIUM COMPOUND AND ZINC DITHIOCARBAMATE | TEXTILE RUBBER & CHEMICAL COMPANY, INC. | 2001-02-13 | — | — | US | claimed |