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 | |
|---|---|---|---|---|
| ▸ | NR5A1 | Q13285 | 1/20 | 0.58 |
| ▸ | LTA4H | P09960 | 4/20 | 0.51 |
| ▸ | TP53 | P04637 | 2/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.50 |
| ▸ | RARB | P10826 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.47 |
| ▸ | RELA | Q04206 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2871871 | 0.98 | NR5A1 (0.59) | NR5A1LTA4HTP53TSHRPLA2G4B | |
| SCHEMBL2873250 | 0.92 | NR5A1 (0.53) | NR5A1LTA4HTP53TSHRPLA2G4B | |
| SCHEMBL1573968 | 0.82 | NR5A1 (0.79) | NR5A1LTA4HTP53TSHRPLA2G4B | |
| SCHEMBL28373061 | 0.82 | NR5A1 (0.79) | NR5A1LTA4HTP53TSHRPLA2G4B | |
| SCHEMBL11322082 | 0.82 | NR5A1 (0.79) | NR5A1LTA4HTP53TSHRPLA2G4B | |
| SCHEMBL2829024 | 0.82 | NR5A1 (0.79) | NR5A1LTA4HTP53TSHRPLA2G4B | |
| SCHEMBL8936597 | 0.82 | NR5A1 (0.79) | NR5A1LTA4HTP53TSHRPLA2G4B | |
| SCHEMBL11095674 | 0.82 | NR5A1 (0.79) | NR5A1LTA4HTP53TSHRPLA2G4B | |
| SCHEMBL10943900 | 0.82 | NR5A1 (0.79) | NR5A1LTA4HTP53TSHRPLA2G4B | |
| SCHEMBL5473083 | 0.82 | NR5A1 (0.79) | NR5A1LTA4HTP53TSHRPLA2G4B |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002066092-A2 | DRUG ELUTING DEVICE FOR TREATING VASCULAR DISEASES | ANGIOGENE INC. (CA) | 2002-08-29 | — | — | WO | disclosed |
| US-20020119178-A1 | Drug eluting device for treating vascular diseases | LEVESQUE LUC (CA) | 2002-08-29 | — | — | US | disclosed |