Known targets — ChEMBL curated mechanism
ABL1BMXBRAFBTKCHRNA4CHRNB2CSNK1EEGFRERBB2F10FLT1FLT3FLT4IGF1RINSRITKJAK3KDRKITOPRM1PARP1PARP2PDGFRBPIK3CDRAF1RETSLC18A2TECTXKdacAdacBdacCftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
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 | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 1/20 | 0.57 |
| ▸ | CA12 | O43570 | 1/20 | 0.51 |
| ▸ | CA2 | P00918 | 1/20 | 0.51 |
| ▸ | CA9 | Q16790 | 1/20 | 0.51 |
| ▸ | THRB | P10828 | 4/20 | 0.50 |
| ▸ | THRA | P10827 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | CNR2 | P34972 | 1/20 | 0.49 |
| ▸ | DNM1 | Q05193 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | ALB | P02768 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Dymanthine SCHEMBL9193253 | 1.00 | MCHR1 (0.57) | MCHR1CA12CA2CA9THRB | |
| SCHEMBL9194045 | 1.00 | MCHR1 (0.57) | MCHR1CA12CA2CA9THRB | |
| SCHEMBL10586091 | 1.00 | MCHR1 (0.57) | MCHR1CA12CA2CA9THRB | |
| SCHEMBL16166017 | 1.00 | MCHR1 (0.57) | MCHR1CA12CA2CA9THRB | |
| SCHEMBL28402844 | 0.98 | MCHR1 (0.55) | MCHR1CA12CA2CA9THRB | |
| SCHEMBL11057295 | 0.91 | MCHR1 (0.57) | MCHR1CA12CA2CA9THRB | |
| SCHEMBL27761358 | 0.91 | MCHR1 (0.57) | MCHR1CA12CA2CA9THRB | |
| SCHEMBL11058775 | 0.91 | MCHR1 (0.57) | MCHR1CA12CA2CA9THRB | |
| SCHEMBL30395774 | 0.90 | CA2 (0.56) | MCHR1CA12CA2CA9THRB | |
| SCHEMBL593014 | 0.89 | MCHR1 (0.68) | MCHR1CA12CA2THRBTHRA |
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 46 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103945827-A | Hair treatment composition with cationic care substance and uv filter | HENKEL AG & CO KGAA | 2014-07-23 | — | — | CN | claimed |
| EP-0675117-A1 | Bromopropargyl quaternary ammonium compounds having antimicrobial activity | ROHM AND HAAS COMPANY (US) | 1995-10-04 | — | — | EP | claimed |
| US-5411933-A | Bromopropargyl quarternary ammonium compounds having antimicrobial activity | ROHM & HAAS COMPANY (US) | 1995-05-02 | — | — | US | claimed |
| US-4490455-A | STEARYL-(OCTYL- OR LAURYL-) DIMETHYL AMINE TOSYLATE | XEROX CORPORATION (US) | 1984-12-25 | — | — | US | claimed |
| CN-103622842-B | Delivery of particles | 宝洁公司 | 2017-10-27 | — | — | CN | disclosed |
| CN-106659644-A | A MULTI-STEP REGIMEN FOR IMPROVING THE APPEARANCE AND FEEL OF HUMAN SKIN | 宝洁公司 | 2017-05-10 | — | — | CN | disclosed |
| CN-102858940-B | Delivery particles | 宝洁公司 | 2017-05-03 | — | — | CN | disclosed |
| CN-104619306-B | Three-layer hair conditioning compositions and consumer products | ELC管理有限责任公司 | 2017-04-26 | — | — | CN | disclosed |
| CN-103797050-B | Comprise the consumer product compositions of organic polysiloxane emulsion | 宝洁公司 | 2016-12-28 | — | — | CN | disclosed |
| CN-103589530-B | Delivery of particles | 宝洁公司 | 2016-08-24 | — | — | CN | disclosed |
| CN-102858944-B | Delivery of particles | 宝洁公司 | 2016-08-24 | — | — | CN | disclosed |
| CN-102883803-B | Delivery particles | THE PROCTER & GAMBLE CO. (US) | 2016-04-27 | — | — | CN | disclosed |
| EP-0835604-A1 | Halopropargyl compounds as marine antifouling agents | ROHM AND HAAS COMPANY (US) | 1998-04-15 | — | — | EP | disclosed |
| EP-0497817-B1 | ELECTROSTATOGRAPHIC PARTICULATE TONER AND DEVELOPER COMPOSITIONS | OLIN HUNT SUB I CORP (US) | 1995-11-29 | — | — | EP | disclosed |
| EP-0497817-A4 | ELECTROSTATOGRAPHIC PARTICULATE TONER AND DEVELOPER COMPOSITIONS | — | 1992-12-16 | — | — | EP | disclosed |
| EP-0497817-A1 | ELECTROSTATOGRAPHIC PARTICULATE TONER AND DEVELOPER COMPOSITIONS. | OLIN HUNT SUB I CORP (US) | 1992-08-12 | — | — | EP | disclosed |
| WO-1991006043-A1 | ELECTROSTATOGRAPHIC PARTICULATE TONER AND DEVELOPER COMPOSITIONS | OLIN HUNT SUB I CORP. (US) | 1991-05-02 | — | — | WO | disclosed |
| US-5009979-A | Resin particles, colorants and charge enhancing additive | OLIN HUNT SPECIALTY PRODUCTS INC. (US) | 1991-04-23 | — | — | US | disclosed |
| US-4490455-A | STEARYL-(OCTYL- OR LAURYL-) DIMETHYL AMINE TOSYLATE | XEROX CORPORATION (US) | 1984-12-25 | — | — | US | disclosed |
| US-4343891-A | CONVERTING TO COMPOUND HAVING FEWER THAN FOUR CARBON-TO-BORON BONDS | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1982-08-10 | — | — | US | disclosed |