Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Phenol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| Phenol SCHEMBL5909808 | 1.00 | — | — | |
| Phenol SCHEMBL6753431 | 0.98 | — | — | |
| Phenol SCHEMBL8669299 | 0.84 | — | — | |
| Toluene SCHEMBL1588792 | 0.82 | LMNA (0.46) | — | |
| Phenol SCHEMBL8665334 | 0.80 | MAOB (0.35) | — | |
| Hydrochloric Acid SCHEMBL221889 | 0.80 | — | — | |
| SCHEMBL6937287 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL9245636 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL2465009 | 0.78 | — | — | |
| Phenol SCHEMBL7545341 | 0.76 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20170114199-A1 | CATALYST FOR OLEFIN POLYMERIZATION AND CO-POLYMERIZATION AND METHOD FOR OLEFIN POLYMERIZATION AND CO-POLYMERIZATION WITH USING THE SAME | HANWHA TOTAL PETROCHEMICAL CO., LTD. | 2017-04-27 | — | — | US | disclosed |
| US-20170015770-A1 | CATALYST FOR OLEFIN POLYMERIZATION AND CO-POLYMNERIZATION AND A METHOD FOR OLEFIN POLYMERIZATION AND CO-POLYMERIZATION WITH USING THE SAME | HANWHA TOTAL PETROCHEMICAL CO., LTD. | 2017-01-19 | — | — | US | disclosed |
| US-9469701-B2 | Polyethylene powder | ASAHI KASEI CHEMICALS CORPORATION (JP) | 2016-10-18 | — | — | US | disclosed |
| US-20160137760-A1 | Polyethylene Powder | ASAHI KASEI CHEMICALS CORPORATION (JP) | 2016-05-19 | — | — | US | disclosed |
| US-20140303332-A1 | CATALYST FOR OLEFIN POLYMERIZATION AND COPOLYMERIZATION, AND OLEFIN POLYMERIZATION OR COPOLYMERIZATION METHOD USING SAME | HANWHA TOTAL PETROCHEMICAL CO., LTD. (KR) | 2014-10-09 | — | — | US | disclosed |
| US-20060287449-A1 | Ultrahigh-molecular ethylene polymer | ASAHI KASEI CHEMICALS CORPORATION (JP) | 2006-12-21 | — | — | US | disclosed |
| EP-1605000-A1 | ULTRAHIGH-MOLECULAR ETHYLENE POLYMER | Asahi Kasei Chemicals Corporation (JP) | 2005-12-14 | — | — | EP | disclosed |