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.
Predicted protein targets (top 2)
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL14380205 | 0.83 | MAOA (0.31) | HDAC6MAOA | |
| SCHEMBL5611753 | 0.83 | MAOA (0.31) | HDAC6MAOA | |
| SCHEMBL6064053 | 0.82 | MAOA (0.31) | HDAC6MAOA | |
| Hydrochloric Acid SCHEMBL5601498 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL6064724 | 0.76 | MAOA (0.38) | HDAC6MAOA | |
| Hydrochloric Acid SCHEMBL5601350 | 0.76 | BCHE (0.31) | — | |
| Hydrochloric Acid SCHEMBL27670456 | 0.76 | METAP2 (0.35) | — | |
| Hydrochloric Acid SCHEMBL27513158 | 0.70 | PDCD1 (0.33) | — | |
| Hydrochloric Acid SCHEMBL3163965 | 0.70 | PDCD1 (0.35) | — | |
| Hydrochloric Acid SCHEMBL29424591 | 0.70 | PDCD1 (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1735354-A1 | HETEROCYCLIC SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION | Exxonmobil Chemical Company Inc. (US) | 2006-12-27 | — | — | EP | disclosed |
| WO-2005105864-A1 | HETEROCYCLIC SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2005-11-10 | — | — | WO | disclosed |