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 SCHEMBL28895 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL10385741 | 0.95 | TSHR (0.36) | — | |
| Bromide SCHEMBL2059865 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL3842243 | 0.71 | TSHR (0.30) | — | |
| Hydrochloric Acid SCHEMBL7530759 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL25425320 | 0.57 | — | — | |
| Hydrochloric Acid SCHEMBL2343985 | 0.57 | TSHR (0.47) | — | |
| Hydrochloric Acid SCHEMBL861608 | 0.57 | — | — | |
| Hydrochloric Acid SCHEMBL17200270 | 0.57 | — | — | |
| Hydrochloric Acid SCHEMBL3189733 | 0.57 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1483276-B1 | FERROCENYL LIGANDS AND THE USE THEREOF IN CATALYSIS | DEGUSSA (DE) | 2005-08-31 | — | — | EP | disclosed |
| EP-1483276-A1 | FERROCENYL LIGANDS AND THE USE THEREOF IN CATALYSIS | Degussa AG (DE) | 2004-12-08 | — | — | EP | disclosed |
| WO-2003076451-A1 | FERROCENYL LIGANDS AND THE USE THEREOF IN CATALYSIS | DEGUSSA AG (DE) | 2003-09-18 | — | — | WO | disclosed |