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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL84 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL29104164 | 0.82 | CYP3A4 (0.33) | — | |
| Hydrochloric Acid SCHEMBL6325454 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL28381463 | 0.82 | CYP3A4 (0.33) | — | |
| Hydrochloric Acid SCHEMBL1727377 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL2255325 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL3522595 | 0.67 | — | — | |
| Water SCHEMBL6737814 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL640769 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL7202242 | 0.67 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1189492-C | Aromatic modified curde C5 cased resins | EXXON CHEMICAL PATENTS INC (US) | 2005-02-16 | — | — | CN | disclosed |
| EP-0991680-B9 | AROMATIC MODIFIED CRUDE C5-BASED RESINS | EXXONMOBIL CHEM PATENTS INC (US) | 2004-01-21 | — | — | EP | disclosed |
| EP-0991680-B1 | AROMATIC MODIFIED CRUDE C5-BASED RESINS | EXXONMOBIL CHEM PATENTS INC (US) | 2003-08-06 | — | — | EP | disclosed |
| US-6455652-B2 | ISOPRENE, DICYCLOPENTADIENE, SUBSTITUTED CYCLOPENTADIENES AND SUBSTITUTED DICYCLOPENTADIENES, PIPERYLENE, AROMATIC OLEFINS, ADDITIONAL ALIPHATIC OLEFINS; PRESSURE SENSITIVE ADHESIVES | EXXONMOBIL CHEMICAL PATENTS INC. | 2002-09-24 | — | — | US | disclosed |
| US-20010031847-A1 | Aromatic modified crude C5 based resins | EXXONMOBIL CHEMICAL PATENTS INC. | 2001-10-18 | — | — | US | disclosed |
| US-6232418-B1 | MIXTURE OF ISOPRENE, DICYCLPENTADIENE, PIPERYLENE, AROMATIC AND ALPHA-OLEFINS COMPOUNDS USING LEWIS ACID CATALYST | EXXON MOBILE CHEMICAL PATENTS, INC | 2001-05-15 | — | — | US | disclosed |
| CN-1257513-A | Aromatic modified curde C5 cased resins | EXXON CHEMICAL PATENTS INC (US) | 2000-06-21 | — | — | CN | disclosed |
| EP-0991680-A1 | AROMATIC MODIFIED CRUDE C 5? BASED RESINS | EXXON CHEMICAL PATENTS INC. (US) | 2000-04-12 | — | — | EP | disclosed |
| WO-1998057999-A1 | AROMATIC MODIFIED CRUDE C5 BASED RESINS | EXXON CHEMICAL PATENTS INC. (US) | 1998-12-23 | — | — | WO | disclosed |