Known targets — ChEMBL curated mechanism
MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Nitroethane. 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 | |
|---|---|---|---|---|
| Alcohol SCHEMBL21297005 | 0.89 | TSHR (0.60) | — | |
| Nitroethane SCHEMBL1332217 | 0.89 | — | — | |
| Nitroethane SCHEMBL35035 | 0.89 | — | — | |
| Nitroethane SCHEMBL7170749 | 0.86 | TSHR (0.58) | — | |
| Alcohol SCHEMBL28240025 | 0.85 | TSHR (0.53) | — | |
| Nitroethane SCHEMBL27939198 | 0.85 | — | — | |
| Nitroethane SCHEMBL29866506 | 0.85 | — | — | |
| Nitroethane SCHEMBL27781345 | 0.85 | — | — | |
| Nitroethane SCHEMBL7774447 | 0.85 | — | — | |
| Alcohol SCHEMBL25333131 | 0.81 | TSHR (0.50) | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-208308740-U | The nitride recovery system of ethylene glycol process units | 河南瀚智化工科技有限公司 | 2019-01-01 | — | — | CN | disclosed |
| EP-0190969-B1 | LIPID OSMOTIC PUMP | MERCK & CO. INC. (US) | 1993-02-24 | — | — | EP | disclosed |
| EP-0169105-B1 | CONTROLLED POROSITY OSMOTIC PUMP | MERCK & CO. INC. (US) | 1991-08-07 | — | — | EP | disclosed |
| US-4968507-A | SUSTAINED RELEASE OF DRUG | MERCK & CO., INC. (US) | 1990-11-06 | — | — | US | disclosed |
| US-4851228-A | Multiparticulate controlled porosity osmotic | MERCK & CO., INC. (US) | 1989-07-25 | — | — | US | disclosed |
| US-4685918-A | Lipid osmotic pump | MERCK & CO., INC. (US) | 1987-08-11 | — | — | US | disclosed |
| EP-0190969-A2 | Lipid osmotic pump | MERCK & CO. INC. (US) | 1986-08-13 | — | — | EP | disclosed |
| EP-0169105-A2 | Controlled porosity osmotic pump | MERCK & CO. INC. (US) | 1986-01-22 | — | — | EP | disclosed |
| US-4484921-A | Theophylline therapy utilizing osmotic delivery | ALZA CORPORATION (US) | 1984-11-27 | — | — | US | disclosed |
| US-4439195-A | Theophylline therapy | ALZA CORPORATION (US) | 1984-03-27 | — | — | US | disclosed |
| US-4326525-A | Osmotic device that improves delivery properties of agent in situ | ALZA CORPORATION (US) | 1982-04-27 | — | — | US | disclosed |
| US-4160020-A | CELLULOSE ESTERS, CELLULOSE ETHERS | ALZA CORPORATION (US) | 1979-07-03 | — | — | US | disclosed |