Known targets — ChEMBL curated mechanism
MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Alcohol. 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 | |
|---|---|---|---|---|
| Propene SCHEMBL10778051 | 0.95 | TSHR (0.33) | — | |
| Ethylene Glycol SCHEMBL11311525 | 0.86 | TSHR (0.37) | — | |
| SCHEMBL35244 | 0.86 | — | — | |
| Acetic Acid SCHEMBL8048187 | 0.83 | FFAR3 (0.41) | — | |
| Propene SCHEMBL27829257 | 0.83 | — | — | |
| Fluoromethane SCHEMBL27544141 | 0.83 | — | — | |
| Ethylene SCHEMBL37185 | 0.83 | — | — | |
| Methane SCHEMBL28424249 | 0.83 | — | — | |
| SCHEMBL29020097 | 0.83 | — | — | |
| SCHEMBL6320805 | 0.83 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6136961-A | TAXOL-2'-ADIPATE DERIVATIVES WITH IMPROVED WATER SOLUBILITY, BERGENIN DERIVATIVES, AND ERYTHROMYCIN DERIVATIVES OF GIVEN FORMULAS; FREE ACID OR SUGAR-CONTAINING DERIVATIVES THEREOF | ENZYMED, INC. (US) | 2000-10-24 | — | — | US | disclosed |
| EP-0871620-A4 | BIOCATALYTIC METHODS FOR SYNTHESIZING AND IDENTIFYING BIOLOGICALLY ACTIVE COMPOUNDS | ENZYMED INC (US) | 1999-10-27 | — | — | EP | disclosed |
| EP-0871620-A1 | BIOCATALYTIC METHODS FOR SYNTHESIZING AND IDENTIFYING BIOLOGICALLY ACTIVE COMPOUNDS | ENZYMED, Inc. (US) | 1998-10-21 | — | — | EP | disclosed |
| WO-1997010233-A1 | BIOCATALYTIC METHODS FOR SYNTHESIZING AND IDENTIFYING BIOLOGICALLY ACTIVE COMPOUNDS | ENZYMED, INC. (US) | 1997-03-20 | — | — | WO | disclosed |