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 | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | BCHE | P06276 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL135136 | 0.98 | — | — | |
| Iodide SCHEMBL3830198 | 0.95 | NPC1 (0.32) | NPC1POLBRAB9ASMN1; SMN2 | |
| SCHEMBL13215505 | 0.74 | — | — | |
| Iodide SCHEMBL5366846 | 0.73 | KDM4E (0.42) | NPC1POLBRAB9ASMN1; SMN2 | |
| Bromide SCHEMBL11484493 | 0.73 | NPC1 (0.41) | NPC1POLBRAB9ASMN1; SMN2BCHE | |
| Benzene SCHEMBL9542509 | 0.73 | KDM4E (0.42) | NPC1POLBRAB9ASMN1; SMN2BCHE | |
| SCHEMBL6162141 | 0.71 | CYP2D6 (0.47) | NPC1RAB9ASMN1; SMN2BCHEACHE | |
| SCHEMBL31130749 | 0.71 | CYP2D6 (0.47) | NPC1RAB9ASMN1; SMN2BCHEACHE | |
| SCHEMBL950597 | 0.70 | KDM4E (0.42) | NPC1POLBRAB9ASMN1; SMN2BCHE | |
| Bromide SCHEMBL6697756 | 0.70 | CYP2D6 (0.46) | NPC1RAB9ASMN1; SMN2BCHEACHE |
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 |
|---|---|---|---|---|---|---|---|
| WO-1993014083-A1 | PHARMACEUTICALLY ACTIVE SUBSTITUTED BENZIMIDAZOLE DERIVATIVES | JANSSEN PHARMACEUTICA N.V. (BE) | 1993-07-22 | — | — | WO | disclosed |