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 | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.32 |
| ▸ | NPC1 | O15118 | 3/20 | 0.32 |
| ▸ | TP53 | P04637 | 3/20 | 0.32 |
| ▸ | RAB9A | P51151 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MITF | O75030 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.31 |
| ▸ | RELA | Q04206 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | PPARG | P37231 | 1/20 | 0.30 |
| ▸ | BRS3 | P32247 | 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 SCHEMBL6902605 | 0.94 | RAB9A (0.39) | SMN1; SMN2NPC1TP53RAB9AKDM4E | |
| Hydrochloric Acid SCHEMBL6903073 | 0.93 | CYP3A4 (0.33) | SMN1; SMN2NPC1RAB9AALDH1A1CYP3A4 | |
| Hydrochloric Acid SCHEMBL6901139 | 0.92 | RAB9A (0.39) | SMN1; SMN2NPC1TP53RAB9AKDM4E | |
| Hydrochloric Acid SCHEMBL6904017 | 0.89 | CYP3A4 (0.37) | SMN1; SMN2NPC1TP53RAB9AKDM4E | |
| Hydrochloric Acid SCHEMBL6902927 | 0.86 | BRS3 (0.35) | NPC1RAB9ABRS3 | |
| Hydrochloric Acid SCHEMBL6904132 | 0.86 | CYP3A4 (0.39) | SMN1; SMN2NPC1TP53RAB9AKDM4E | |
| SCHEMBL6902576 | 0.84 | SMN1; SMN2 (0.33) | SMN1; SMN2NPC1TP53RAB9AKDM4E | |
| Hydrochloric Acid SCHEMBL6897621 | 0.84 | CYP3A4 (0.33) | CYP3A4CYP2A6CCR1CCR5CCR8 | |
| Hydrochloric Acid SCHEMBL6899130 | 0.84 | CYP3A4 (0.30) | CYP3A4CYP2A6 | |
| Hydrochloric Acid SCHEMBL7733570 | 0.83 | CYP3A4 (0.33) | CYP3A4CYP2A6CCR1CCR5CCR8 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1033371-B1 | Transition metal compound, catalyst system, process for the preparation thereof and its use for the polymerization of olefins | BASELL POLYOLEFINE GMBH (DE) | 2004-01-28 | — | — | EP | claimed |
| US-6458982-B1 | CATALYST SYSTEM COMPRISING AT LEAST ONE METALLOCENE AND AT LEAST ONE COCATALYST. ON SUPPORT. | TARGOR GMBH (DE) | 2002-10-01 | — | — | US | disclosed |