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 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR3 | P46089 | 2/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.30 |
| ▸ | TNKS2 | Q9H2K2 | 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 SCHEMBL14735449 | 0.74 | GPR3 (0.35) | GPR3HTR2APOLBPBRM1TNKS2 | |
| Hydrochloric Acid SCHEMBL911069 | 0.74 | GPR3 (0.35) | GPR3HTR2APOLBPBRM1TNKS2 | |
| Hydrochloric Acid SCHEMBL6908726 | 0.74 | GPR3 (0.35) | GPR3HTR2APOLBPBRM1TNKS2 | |
| SCHEMBL5356718 | 0.73 | GPR3 (0.38) | GPR3HTR2ACYP1A2CYP2D6POLB | |
| SCHEMBL29385315 | 0.73 | GPR3 (0.38) | GPR3HTR2ACYP1A2CYP2D6POLB | |
| Hydrochloric Acid SCHEMBL27561373 | 0.72 | GPR3 (0.34) | GPR3HTR2AEPHX2TNKS2 | |
| Hydrochloric Acid SCHEMBL3627628 | 0.72 | GPR3 (0.34) | GPR3HTR2A | |
| SCHEMBL8028884 | 0.71 | GPR3 (0.37) | GPR3HTR2ACYP1A2CYP2D6POLB | |
| SCHEMBL9146475 | 0.71 | GPR3 (0.37) | GPR3HTR2ACYP1A2CYP2D6POLB | |
| SCHEMBL9146467 | 0.71 | GPR3 (0.37) | GPR3HTR2ACYP1A2CYP2D6POLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1520862-B1 | Butadiene polymer, and process for producing conjugated diene polymer | AGENCY IND SCIENCE TECHN (JP) | 2008-05-28 | — | — | EP | disclosed |