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 SCHEMBL7931298 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL7195300 | 0.90 | MAPT (0.31) | — | |
| SCHEMBL5174322 | 0.87 | MAPT (0.33) | — | |
| Hydrochloric Acid SCHEMBL7940232 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL7939984 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL7605151 | 0.82 | KDM4E (0.30) | — | |
| SCHEMBL6695436 | 0.82 | NPC1 (0.35) | — | |
| Hydrochloric Acid SCHEMBL9229867 | 0.81 | CYP19A1 (0.32) | — | |
| Hydrochloric Acid SCHEMBL6559465 | 0.81 | MEN1 (0.31) | — | |
| Hydrochloric Acid SCHEMBL9226383 | 0.81 | SLC6A2 (0.32) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5451649-A | Organometallic fluorenyl compounds, preparation, and use | PHILLIPS PETROLEUM COMPANY (US) | 1995-09-19 | — | — | US | claimed |
| EP-1123938-A2 | Organometallic fluorenyl compounds, preparation, and use | PHILLIPS PETROLEUM COMPANY (US) | 2001-08-16 | — | — | EP | disclosed |