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 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 3/20 | 0.54 |
| ▸ | APEX1 | P27695 | 3/20 | 0.61 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | SLC5A7 | Q9GZV3 | 1/20 | 0.57 |
| ▸ | MEN1 | O00255 | 5/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.54 |
| ▸ | LMNA | P02545 | 3/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | DNM1 | Q05193 | 6/20 | 0.47 |
| ▸ | BBOX1 | O75936 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL235599 | 0.94 | MEN1 (0.58) | APEX1NPSR1CYP3A4SLC5A7MEN1 | |
| Water SCHEMBL4489648 | 0.89 | MEN1 (0.54) | APEX1NPSR1CYP3A4SLC5A7MEN1 | |
| Iodide SCHEMBL1982646 | 0.89 | MEN1 (0.54) | APEX1NPSR1CYP3A4SLC5A7MEN1 | |
| Bromide SCHEMBL11130043 | 0.89 | MEN1 (0.61) | APEX1NPSR1CYP3A4SLC5A7MEN1 | |
| Fluoride Ion SCHEMBL1444803 | 0.89 | MEN1 (0.54) | APEX1NPSR1CYP3A4SLC5A7MEN1 | |
| SCHEMBL14754176 | 0.80 | MEN1 (0.47) | APEX1NPSR1CYP3A4SLC5A7MEN1 | |
| Hydrochloric Acid SCHEMBL4541161 | 0.80 | APEX1 (0.77) | APEX1NPSR1CYP3A4SLC5A7MEN1 | |
| Decamethonium SCHEMBL2830377 | 0.77 | APEX1 (1.00) | APEX1NPSR1CYP3A4SLC5A7MEN1 | |
| Hydrochloric Acid SCHEMBL20769541 | 0.77 | DNM1 (0.56) | APEX1NPSR1CYP3A4SLC5A7MEN1 | |
| Hydrochloric Acid SCHEMBL3679398 | 0.77 | APEX1 (1.00) | APEX1NPSR1CYP3A4SLC5A7MEN1 |
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 19 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112028553-A | Material for engineering tunnel and subway tunneling and preparation method thereof | 濮阳市诚信钻采助剂有限公司 | 2020-12-04 | — | — | CN | disclosed |
| US-5942722-A | CL-20 COATED WITH SHOCK SENSITIVITY REDUCING AGENTS TO REDUCE THE SUSCEPTIBILITY TO IMPACT AND SYMPATHETIC DETONATION ANDIMPART AN INCREASE IN HDC IMPACT VALUE WHICH IS STATISTICALLY SIGNIFICANT; USING ANIONIC AROMATIC AGENTS | EASTMAN CHEMICAL COMPANY (US) | 1999-08-24 | — | — | US | disclosed |
| US-5942721-A | CL-20 COATED WITH SHOCK SENSITIVITY REDUCING AGENTS TO REDUCE THE SUSCEPTIBILITY TO IMPACT AND SYMPATHETIC DETONATION ANDIMPART AN INCREASE IN HDC IMPACT VALUE WHICH IS STATISTICALLY SIGNIFICANT; USING ANIONIC AROMATIC AGENTS | EASTMAN CHEMICAL COMPANY (US) | 1999-08-24 | — | — | US | disclosed |
| US-5936196-A | 2,4,6,8,10,12-HEXANITROHEXAAZOISONURTITANE COATED WITH AMINE SHOCK SENSITIVITY REDUCING AGENT | EASTMAN CHEMICAL CO. (US) | 1999-08-10 | — | — | US | disclosed |
| EP-0932591-A1 | EXPLOSIVE FORMULATIONS | EASTMAN CHEMICAL COMPANY (US) | 1999-08-04 | — | — | EP | disclosed |
| EP-0898553-A1 | EXPLOSIVE FORMULATIONS | EASTMAN CHEMICAL COMPANY (US) | 1999-03-03 | — | — | EP | disclosed |
| EP-0896576-A1 | EXPLOSIVE FORMULATIONS | EASTMAN CHEMICAL COMPANY (US) | 1999-02-17 | — | — | EP | disclosed |
| EP-0896574-A1 | EXPLOSIVE FORMULATIONS | EASTMAN CHEMICAL COMPANY (US) | 1999-02-17 | — | — | EP | disclosed |
| EP-0896575-A1 | EXPLOSIVE FORMULATIONS | EASTMAN CHEMICAL COMPANY (US) | 1999-02-17 | — | — | EP | disclosed |
| US-5808234-A | CYCLOTRIMETHYLENE-TRINITRAMINE EXPLOSIVE CONTAINING A SHOCK SENSITIVITY REDUCING AGENT COMPRISING TRIALKYL POLYOXYALKYLENE QUATERNARY AMMONIUM CHLORIDE EXHIBITS ANTISTATIC PROPERTIES | EASTMAN CHEMICAL COMPANY (US) | 1998-09-15 | — | — | US | disclosed |
| US-5801326-A | Explosive formulations | EASTMAN CHEMICAL COMPANY (US) | 1998-09-01 | — | — | US | disclosed |
| WO-1998016485-A1 | EXPLOSIVE FORMULATIONS | EASTMAN CHEMICAL COMPANY (US) | 1998-04-23 | — | — | WO | disclosed |
| WO-1997042138-A1 | EXPLOSIVE FORMULATIONS | EASTMAN CHEMICAL COMPANY (US) | 1997-11-13 | — | — | WO | disclosed |
| WO-1997042137-A1 | EXPLOSIVE FORMULATIONS | EASTMAN CHEMICAL COMPANY (US) | 1997-11-13 | — | — | WO | disclosed |
| WO-1997042139-A1 | EXPLOSIVE FORMULATIONS | EASTMAN CHEMICAL COMPANY (US) | 1997-11-13 | — | — | WO | disclosed |
| WO-1997042140-A1 | EXPLOSIVE FORMULATIONS | EASTMAN CHEMICAL COMPANY (US) | 1997-11-13 | — | — | WO | disclosed |
| US-5171830-A | Catalytic process for the preparation of polyalkylene carbonates | ARCO CHEMICAL TECHNOLOGY, L.P. (US) | 1992-12-15 | — | — | US | disclosed |
| US-4334022-A | BY CULTIVATING IN A CULTURE MEDIUM CONTAINING AN N-METHYL COMPOUND | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1982-06-08 | — | — | US | disclosed |
| US-3954650-A | Amine hardner compositions | UNION CARBIDE CORPORATION (US) | 1976-05-04 | — | — | US | disclosed |