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 | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 9/20 | 0.33 |
| ▸ | BCHE | P06276 | 7/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | XBP1 | P17861 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL16470346 | 1.00 | ACHE (0.33) | ACHEBCHENPC1RAB9AMAPT | |
| SCHEMBL28933474 | 0.75 | ACHE (0.33) | ACHEBCHENPC1RAB9AMAPT | |
| SCHEMBL16469849 | 0.75 | MAPT (0.39) | ACHEBCHENPC1RAB9AMAPT | |
| SCHEMBL16469707 | 0.73 | NPC1 (0.43) | ACHEBCHENPC1RAB9AMAPT | |
| Iodide SCHEMBL11593493 | 0.73 | ACHE (0.39) | ACHEBCHENPC1RAB9AMAPT | |
| Hydrochloric Acid SCHEMBL3913860 | 0.73 | ATM (0.52) | ACHEBCHENPC1RAB9AMAPT | |
| SCHEMBL3399835 | 0.73 | ATM (0.52) | ACHEBCHENPC1RAB9AMAPT | |
| Hydrochloric Acid SCHEMBL9205826 | 0.72 | ACHE (0.47) | ACHEBCHENPC1RAB9AMAPT | |
| SCHEMBL16470624 | 0.71 | POLB (0.42) | ACHEBCHENPC1RAB9AMAPT | |
| SCHEMBL16470550 | 0.71 | CYP1A2 (0.35) | ACHEBCHENPC1RAB9AMAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0675924-B1 | CYCLIC-SUBSTITUTED UNSYMMETRICAL CYANINE DYES | MOLECULAR PROBES INC (US) | 2001-12-12 | — | — | EP | disclosed |
| EP-0675924-A1 | CYCLIC-SUBSTITUTED UNSYMMETRICAL CYANINE DYES | MOLECULAR PROBES, INC. (US) | 1995-10-11 | — | — | EP | disclosed |
| US-5436134-A | Fluorescent dyes for nucleic acids | MOLECULAR PROBES, INC. (US) | 1995-07-25 | — | — | US | disclosed |
| WO-1994024213-A1 | CYCLIC-SUBSTITUTED UNSYMMETRICAL CYANINE DYES | MOLECULAR PROBES, INC. (US) | 1994-10-27 | — | — | WO | disclosed |