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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA1 known ✓ | P02708 | 1/20 | 0.33 |
| ▸ | CHRNG known ✓ | P07510 | 1/20 | 0.33 |
| ▸ | CHRNB1 known ✓ | P11230 | 1/20 | 0.33 |
| ▸ | SLC6A2 known ✓ | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.33 |
| ▸ | CHRND known ✓ | Q07001 | 1/20 | 0.33 |
| ▸ | EDNRB | P24530 | 1/20 | 0.38 |
| ▸ | EDNRA | P25101 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.37 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.37 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 2/20 | 0.36 |
| ▸ | PPARA | Q07869 | 2/20 | 0.36 |
| ▸ | NTSR1 | P30989 | 2/20 | 0.35 |
| ▸ | ENPP1 | P22413 | 2/20 | 0.35 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 4/20 | 0.34 |
| ▸ | CA1 | P00915 | 4/20 | 0.34 |
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 SCHEMBL8917407 | 0.96 | EDNRB (0.39) | EDNRBEDNRAMCL1ACMSDCHRNB4 | |
| Hydrochloric Acid SCHEMBL7939285 | 0.75 | CYP1A2 (0.32) | HTR2CPDE10A | |
| Hydrochloric Acid SCHEMBL7939287 | 0.74 | PDE10A (0.36) | PDE10A | |
| Hydrochloric Acid SCHEMBL6559419 | 0.72 | MAPT (0.35) | PDE10ASLC6A2SLC6A4SLC6A3 | |
| Hydrochloric Acid SCHEMBL5352654 | 0.71 | HTR2A (0.47) | CA1CA2PDE10ASLC6A2SLC6A4 | |
| Hydrochloric Acid SCHEMBL7940441 | 0.70 | NPC1 (0.34) | — | |
| SCHEMBL27810529 | 0.70 | EDNRB (0.49) | EDNRBEDNRAMCL1ACMSDCHRNB4 | |
| SCHEMBL27810528 | 0.70 | EDNRB (0.46) | EDNRBEDNRAMCL1ACMSDPPARG | |
| Hydrochloric Acid SCHEMBL8580687 | 0.69 | GRM5 (0.38) | — | |
| Hydrochloric Acid SCHEMBL8918393 | 0.69 | NPC1 (0.41) | PDE10A |
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-5668230-A | METALLOCENE WITH ETHYLENE BRIDGED FLUORENE UNITS, ALUMOXANE COCATALYST | PHILLIPS PETROLEUM COMPANY (US) | 1997-09-16 | — | — | US | claimed |