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 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | CHKA | P35790 | 2/20 | 0.31 |
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 SCHEMBL11537265 | 0.86 | ALDH1A1 (0.40) | CA1CA2NPSR1CHKA | |
| Bromide SCHEMBL11537233 | 0.85 | LMNA (0.42) | CHKA | |
| Hydrochloric Acid SCHEMBL11536281 | 0.82 | NPSR1 (0.43) | CA1CA2NPSR1 | |
| SCHEMBL11539146 | 0.80 | NPSR1 (0.44) | CA1CA2NPSR1CHKA | |
| Bromide SCHEMBL11536307 | 0.79 | LMNA (0.39) | — | |
| Bromide SCHEMBL11533878 | 0.79 | CA1 (0.45) | CA1CA2NPSR1CHKA | |
| Hydrochloric Acid SCHEMBL11534884 | 0.77 | SMN1; SMN2 (0.39) | NPSR1 | |
| Hydrochloric Acid SCHEMBL11537914 | 0.77 | KDM4E (0.35) | CA1CA2NPSR1 | |
| Hydrochloric Acid SCHEMBL11534283 | 0.77 | POLB (0.36) | — | |
| Hydrochloric Acid SCHEMBL11539012 | 0.77 | CHKA (0.41) | NPSR1CHKA |
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 |
|---|---|---|---|---|---|---|---|
| US-4163745-A | ANTIDIABETIC, HYPOGLYCEMIC | PFIZER INC. (US) | 1979-08-07 | — | — | US | disclosed |
| US-4129567-A | IMIDAZOPYRIDINES AND ISOB IDINE | PFIZER INC. (US) | 1978-12-12 | — | — | US | disclosed |
| US-4093616-A | PYRROLO(1,2-A)PYRAZINIUM, PYRAZOLO(1,5-A)PYRIDINIUM, 1H-IMIDAZO(2,1-A)ISOQUINOLINIUM, OR IMIDAZO(5,1-A)ISOQUINOLINIUM SALTS | PFIZER INC. (US) | 1978-06-06 | — | — | US | disclosed |
| US-4044015-A | Imidazopyridinium compounds as hypoglycemic agents | PFIZER INC. (US) | 1977-08-23 | — | — | US | disclosed |