Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Hydrochloric Acid. 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 | |
|---|---|---|---|---|
| SCHEMBL313105 | 0.98 | — | — | |
| SCHEMBL3672569 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL311809 | 0.72 | — | — | |
| SCHEMBL313104 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL397742 | 0.66 | — | — | |
| Hydrochloric Acid SCHEMBL18420499 | 0.66 | — | — | |
| Hydrochloric Acid SCHEMBL3682110 | 0.66 | — | — | |
| Hydrochloric Acid SCHEMBL397166 | 0.66 | — | — | |
| Hydrochloric Acid SCHEMBL18092790 | 0.65 | — | — | |
| SCHEMBL6656067 | 0.65 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20130237719-A1 | Preparation and Use of Tetrasubstituted Fluorenyl Catalysts for Polymerization of Olefins | FINA TECHNOLOGY, INC. (US) | 2013-09-12 | — | — | US | disclosed |
| US-20120095175-A1 | PREPARATION AND USE OF TETRASUBSTITUTED FLUORENYL CATALYSTS FOR POLYMERIZATION OF OLEFINS | FINA TECHNOLOGY, INC. (US) | 2012-04-19 | — | — | US | disclosed |
| US-8093418-B2 | Metallocenes; for production of ethylene/propylene homo-/copolymers | FINA TECHNOLOGY, INC. (US) | 2012-01-10 | — | — | US | disclosed |
| EP-1915401-A2 | PREPARATION AND USE OF TETRASUBSTITUTED FLUORENYL CATALYSTS FOR POLMERIZATION OF OLEFINS | FINA TECHNOLOGY, INC. (US) | 2008-04-30 | — | — | EP | disclosed |
| US-7335711-B2 | Preparation and use of tetrasubstituted fluorenyl catalysts for polymerization of olefins | FINA TECHNOLOGY, INC. (US) | 2008-02-26 | — | — | US | disclosed |
| US-20080026935-A1 | Preparation and Use of Tetrasubstituted Fluorenyl Catalysts for Polymerization of Olefins | FINA TECHNOLOGY, INC. (US) | 2008-01-31 | — | — | US | disclosed |
| WO-2007022244-A2 | PREPARATION AND USE OF TETRASUBSTITUTED FLUORENYL CATALYSTS FOR POLMERIZATION OF OLEFINS | FINA TECHNOLOGY, INC. (US) | 2007-02-22 | — | — | WO | disclosed |
| US-20070043183-A1 | Preparation and use of tetrasubstituted fluorenyl catalysts for polymerization of olefins | FINA TECHNOLOGY, INC. | 2007-02-22 | — | — | US | disclosed |