Known targets — ChEMBL curated mechanism
MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Propyne. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
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 | |
|---|---|---|---|---|
| Ethylene Glycol SCHEMBL10483446 | 0.82 | TSHR (0.46) | — | |
| Ethylene Glycol SCHEMBL2457180 | 0.82 | — | — | |
| Propyne SCHEMBL5167822 | 0.80 | — | — | |
| Alcohol SCHEMBL11570295 | 0.78 | — | — | |
| Propyne SCHEMBL11222470 | 0.78 | — | — | |
| Alcohol SCHEMBL4488728 | 0.78 | — | — | |
| Alcohol SCHEMBL36753 | 0.75 | — | — | |
| Alcohol SCHEMBL412481 | 0.75 | — | — | |
| Alcohol SCHEMBL2464657 | 0.74 | TSHR (1.00) | — | |
| Propyne SCHEMBL1330783 | 0.74 | — | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1991718-B1 | CORROSION INHIBITORS | BROMINE COMPOUNDS LTD (IL) | 2013-08-07 | — | — | EP | claimed |
| US-20100167966-A1 | CORROSION INHIBITORS | BROMINE COMPOUNDS LTD. (IL) | 2010-07-01 | — | — | US | claimed |
| EP-1991718-A1 | CORROSION INHIBITORS | Bromine Compounds Ltd. (IL) | 2008-11-19 | — | — | EP | claimed |
| WO-2007093987-A1 | CORROSION INHIBITORS | BROMINE COMPOUNDS LTD. (IL) | 2007-08-23 | — | — | WO | claimed |
| CN-114409601-A | Synthesis method of 2-propyn-1-yl 1H-imidazole-1-carboxylic ester | 石家庄圣泰化工有限公司 | 2022-04-29 | — | — | CN | disclosed |
| EP-1991718-B1 | CORROSION INHIBITORS | BROMINE COMPOUNDS LTD (IL) | 2013-08-07 | — | — | EP | disclosed |
| US-8119573-B2 | Corrosion inhibitors | BROMINE COMPOUNDS LTD. (IL) | 2012-02-21 | — | — | US | disclosed |
| US-20110278504-A1 | LIQUID COMPOSITION SUITABLE FOR USE AS A CORROSION INHABITOR AND A METHOD FOR ITS PREPARATION | BROMINE COMPOUNDS LTD. (IL) | 2011-11-17 | — | — | US | disclosed |
| US-8007689-B2 | Liquid composition suitable for use as a corrosion inhibitor and a method for its preparation | BROMINE COMPOUNDS LTD. (IL) | 2011-08-30 | — | — | US | disclosed |
| US-20100167966-A1 | CORROSION INHIBITORS | BROMINE COMPOUNDS LTD. (IL) | 2010-07-01 | — | — | US | disclosed |
| US-20090050853-A1 | Liquid composition suitable for use as a corrosion inhibitor and a method for its preparation | BROMINE COMPOUNDS LTD. (IL) | 2009-02-26 | — | — | US | disclosed |
| EP-1991718-A1 | CORROSION INHIBITORS | Bromine Compounds Ltd. (IL) | 2008-11-19 | — | — | EP | disclosed |
| WO-2007093987-A1 | CORROSION INHIBITORS | BROMINE COMPOUNDS LTD. (IL) | 2007-08-23 | — | — | WO | disclosed |