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 SCHEMBL8628712 | 0.87 | HTR1A (0.30) | — | |
| Hydrochloric Acid SCHEMBL8636180 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL8635789 | 0.83 | PDK2 (0.30) | — | |
| Hydrochloric Acid SCHEMBL4658161 | 0.82 | HTR1A (0.32) | — | |
| Hydrochloric Acid SCHEMBL6891980 | 0.80 | HTR1A (0.30) | — | |
| Fluoride Ion SCHEMBL7644991 | 0.79 | HTR1A (0.32) | — | |
| Hydrochloric Acid SCHEMBL6889790 | 0.79 | HTR1A (0.32) | — | |
| Hydrochloric Acid SCHEMBL1583097 | 0.78 | CYP11B1 (0.30) | — | |
| Hydrochloric Acid SCHEMBL8628992 | 0.76 | CYP11B1 (0.30) | — | |
| Hydrochloric Acid SCHEMBL9069222 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5776851-A | COORDINATION POLYMERIZATION CATALYST | TARGOR GMBH (DE) | 1998-07-07 | — | — | US | claimed |
| US-5776851-A | COORDINATION POLYMERIZATION CATALYST | TARGOR GMBH (DE) | 1998-07-07 | — | — | US | disclosed |
| US-5693730-A | METALLOCENES HAVING MORE THAN ONE CENTRAL ATOM AND A SPECIAL BRIDGE STRUCTURE FOR PREPARING ISOTACTIC, HIGH-MOLECULAR-WEIGHT POLYMERS HAVING GOOD GRAIN MORPHOLOGY; PROPYLENE HOMO- AND COPOLYMERS | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-12-02 | — | — | US | disclosed |