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 | |
|---|---|---|---|---|
| Bromide SCHEMBL27933363 | 0.96 | — | — | |
| Iodide SCHEMBL27932958 | 0.96 | — | — | |
| Hydrochloric Acid SCHEMBL3644219 | 0.88 | — | — | |
| Hydrochloric Acid SCHEMBL27855352 | 0.84 | ACHE (0.33) | — | |
| Bromide SCHEMBL27948755 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL6332811 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL8453417 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL6340257 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL6333029 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL6330364 | 0.80 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100564402-C | Method for hydrogenating polymer containing conjugated diene unit and hydrogenation catalyst composition thereof | TSRC CORP (CN) | 2009-12-02 | — | — | CN | claimed |
| CN-101205268-A | Method for hydrogenating conjugated diene polymer and hydrogenation catalyst composition | TSRC CORP (CN) | 2008-06-25 | — | — | CN | claimed |
| CN-101016348-A | Method for hydrogenating polymer containing conjugated diene unit and hydrogenation catalyst composition thereof | TSRC CORP (CN) | 2007-08-15 | — | — | CN | claimed |
| CN-101205268-B | Method for hydrogenating conjugated diene polymer and hydrogenation catalyst composition | TSRC CORP | 2010-09-29 | — | — | CN | disclosed |
| CN-100564402-C | Method for hydrogenating polymer containing conjugated diene unit and hydrogenation catalyst composition thereof | TSRC CORP (CN) | 2009-12-02 | — | — | CN | disclosed |
| CN-101205268-A | Method for hydrogenating conjugated diene polymer and hydrogenation catalyst composition | TSRC CORP (CN) | 2008-06-25 | — | — | CN | disclosed |
| CN-101016348-A | Method for hydrogenating polymer containing conjugated diene unit and hydrogenation catalyst composition thereof | TSRC CORP (CN) | 2007-08-15 | — | — | CN | disclosed |
| US-5965758-A | Method for producing bridged type transition metal complex | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1999-10-12 | — | — | US | disclosed |