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 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALPL | P05186 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | GSK3B | P49841 | 1/20 | 0.30 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.30 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.30 |
| ▸ | GALR1 | P47211 | 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 SCHEMBL27537067 | 0.90 | NISCH (0.38) | NISCHPTPN1KDM4EALPLGAA | |
| Hydrochloric Acid SCHEMBL7926454 | 0.75 | NISCH (0.34) | NISCHPTPN1KDM4EALPLGAA | |
| SCHEMBL1029739 | 0.70 | SLC6A3 (0.40) | NISCHPTPN1KDM4EALPLGAA | |
| Hydrochloric Acid SCHEMBL27546014 | 0.69 | NISCH (0.38) | NISCHPTPN1KDM4EALPLGAA | |
| Hydrochloric Acid SCHEMBL7938716 | 0.66 | PTPN1 (0.32) | NISCHPTPN1KDM4E | |
| SCHEMBL19593316 | 0.65 | PTPN1 (0.41) | NISCHPTPN1KDM4EALPLGAA | |
| Hydrochloric Acid SCHEMBL7936599 | 0.64 | PTPN1 (0.31) | NISCHPTPN1 | |
| Hydrochloric Acid SCHEMBL7938955 | 0.64 | NISCH (0.34) | NISCHPTPN1KDM4EALPLGAA | |
| Hydrochloric Acid SCHEMBL7938719 | 0.63 | SLC6A3 (0.33) | NISCHPTPN1KDM4E | |
| Hydrochloric Acid SCHEMBL7935976 | 0.62 | NISCH (0.33) | NISCHPTPN1KDM4EALPLGAA |
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-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 |
| CN-1274360-A | Processes for prepn. of metallocene complexes | CHISSO CORP (JP) | 2000-11-22 | — | — | CN | disclosed |