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 | |
|---|---|---|---|---|
| SCHEMBL2190934 | 0.89 | — | — | |
| SCHEMBL11761307 | 0.86 | — | — | |
| SCHEMBL28781243 | 0.75 | — | — | |
| SCHEMBL308429 | 0.67 | — | — | |
| SCHEMBL30409038 | 0.67 | — | — | |
| SCHEMBL106461 | 0.62 | — | — | |
| SCHEMBL23701241 | 0.62 | — | — | |
| SCHEMBL19336683 | 0.62 | — | — | |
| SCHEMBL17718003 | 0.62 | — | — | |
| SCHEMBL8679741 | 0.62 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111072743-B | Synthetic method of loteprednol etabonate intermediate | 天津药业研究院股份有限公司 | 2022-06-14 | — | — | CN | claimed |
| CN-111072743-A | Synthetic method of loteprednol etabonate intermediate | 天津药业研究院有限公司 | 2020-04-28 | — | — | CN | claimed |
| CN-111072743-B | Synthetic method of loteprednol etabonate intermediate | 天津药业研究院股份有限公司 | 2022-06-14 | — | — | CN | disclosed |
| CN-111072743-A | Synthetic method of loteprednol etabonate intermediate | 天津药业研究院有限公司 | 2020-04-28 | — | — | CN | disclosed |