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 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.35 |
| ▸ | BCL2 | P10415 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | MGLL | Q99685 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7936857 | 0.79 | CYP1A1 (0.32) | NISCH | |
| Hydrochloric Acid SCHEMBL7926797 | 0.77 | BCL2 (0.37) | NISCHBCL2PTGS2IDO1TP53 | |
| Hydrochloric Acid SCHEMBL7935863 | 0.76 | NISCH (0.35) | NISCHBCL2PTGS2IDO1TP53 | |
| Hydrochloric Acid SCHEMBL7933333 | 0.76 | NISCH (0.35) | NISCHBCL2PTGS2IDO1TP53 | |
| Hydrochloric Acid SCHEMBL7935926 | 0.75 | NISCH (0.36) | NISCHBCL2PTGS2IDO1TP53 | |
| Hydrochloric Acid SCHEMBL2401870 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL7936168 | 0.71 | NISCH (0.39) | NISCHBCL2PTGS2IDO1MGLL | |
| Hydrochloric Acid SCHEMBL28743354 | 0.71 | NISCH (0.43) | NISCHBCL2PTGS2IDO1TP53 | |
| Hydrochloric Acid SCHEMBL27519789 | 0.71 | NISCH (0.43) | NISCHBCL2PTGS2IDO1TP53 | |
| Hydrochloric Acid SCHEMBL7926886 | 0.70 | NISCH (0.32) | NISCH |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6184402-B1 | RESOLUTION OF A STEREOISOMERIC MIXTURE OF SPECIFIC METALLOCENE COMPLEXES BRIDGED WITH A TRANSITION METAL HAVING AN OXYGEN BOND ATTACHED, I.E., A MU-OXO COMPLEX; HYDROLYSIS IN THE PRESENCE OF A BASE; SEPARATION OF MESO FORM FROM MIXES | CHISSO CORPORATION (JP) | 2001-02-06 | — | — | US | disclosed |