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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 3/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.32 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | PSIP1 | O75475 | 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 SCHEMBL6251721 | 1.00 | TDP1 (0.38) | TDP1CYP3A4TP53ESR1ESR2 | |
| Hydrochloric Acid SCHEMBL5591121 | 0.95 | TDP1 (0.38) | TDP1CYP3A4TP53ESR1ESR2 | |
| Hydrochloric Acid SCHEMBL27990220 | 0.95 | TDP1 (0.38) | TDP1CYP3A4TP53ESR1ESR2 | |
| SCHEMBL163845 | 0.95 | TDP1 (0.41) | TDP1CYP3A4TP53ESR1ESR2 | |
| Hydrochloric Acid SCHEMBL6250361 | 0.93 | TDP1 (0.39) | TDP1CYP3A4TP53ESR1ESR2 | |
| SCHEMBL3068169 | 0.93 | TDP1 (0.39) | TDP1CYP3A4TP53ESR1ESR2 | |
| SCHEMBL5921753 | 0.93 | TDP1 (0.39) | TDP1CYP3A4TP53ESR1ESR2 | |
| SCHEMBL3997009 | 0.93 | TDP1 (0.39) | TDP1CYP3A4TP53ESR1ESR2 | |
| Hydrochloric Acid SCHEMBL7505836 | 0.93 | TDP1 (0.39) | TDP1CYP3A4TP53ESR1ESR2 | |
| Ammonia Solution, Strong SCHEMBL2244152 | 0.93 | TDP1 (0.39) | TDP1CYP3A4TP53ESR1ESR2 |
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 58 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1123298-A4 | 2-ALKYL-4-(2,6-DIALKYLPHENYL) INDENES | BOULDER SCIENT CO (US) | 2002-08-07 | — | — | EP | claimed |
| US-6291699-B1 | TO PRODUCE BRIDGED METALLOCENE LIGANDS WHICH CAN BE CONVERTED INTO BRIDGED METALLOCENES USEFUL AS OLFIN POLYMERIZATION CATALYST | BOULDER SCIENTIFIC COMPANY | 2001-09-18 | — | — | US | claimed |
| EP-1123298-A1 | 2-ALKYL-4-(2,6-DIALKYLPHENYL) INDENES | BOULDER SCIENTIFIC COMPANY (US) | 2001-08-16 | — | — | EP | claimed |
| WO-2001014388-A1 | 2-ALKYL-4-(2,6-DIALKYLPHENYL) INDENES | BOULDER SCIENTIFIC COMPANY (US) | 2001-03-01 | — | — | WO | claimed |
| US-6166172-A | Method of forming poly-(3-substituted) thiophenes | CARNEGIE MELLON UNIVERSITY (US) | 2000-12-26 | — | — | US | claimed |
| JP-1040477-A | — | — | None | — | — | JP | disclosed |
| CN-112479901-B | Organic compound with indeno-anthracene derivative as core and application thereof | 江苏三月科技股份有限公司 | 2023-04-07 | — | — | CN | disclosed |
| CN-112479904-B | Organic compound with indeno-anthracene derivative as core and application thereof | 江苏三月科技股份有限公司 | 2023-04-07 | — | — | CN | disclosed |
| CN-107840834-B | Benzopyrene compound and application thereof | 北京鼎材科技有限公司 | 2022-10-04 | — | — | CN | disclosed |
| CN-109962166-B | Organic electroluminescent device and preparation method thereof | 固安鼎材科技有限公司 | 2022-06-07 | — | — | CN | disclosed |
| CN-114478265-A | Arylamine compound and application thereof in organic electroluminescent device | 江苏三月科技股份有限公司 | 2022-05-13 | — | — | CN | disclosed |
| US-11213800-B2 | Covalent organic framework films, and methods of making and uses of same | CORNELL UNIVERSITY (US) | 2022-01-04 | — | — | US | disclosed |
| US-5693841-A | Cyclohexanone compounds, process for preparing the same, and processes for preparing silacyclohexane-based liquid crystal compounds from the cyclohexanone compounds | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1997-12-02 | — | — | US | disclosed |
| EP-0765880-A1 | Process for preparing sil acyclohexane-based liquid crystal compounds from silacyclohexanone compounds | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1997-04-02 | — | — | EP | disclosed |
| US-5527490-A | Silacyclohexane carbaldehyde compounds and processes for preparing silacyclohexane-based liquid crystal compounds from the carbaldehyde compound | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1996-06-18 | — | — | US | disclosed |
| EP-0711777-A1 | Cyclohexanone compounds, a process for preparing the cyclohexanone compounds, and a process for preparing silacyclohexane-based compounds from the cyclohexanone compounds | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1996-05-15 | — | — | EP | disclosed |
| EP-0687678-A1 | Cyclohexanone compounds, process for preparing the same, and processes for preparing silacyclohexane-based liquid crystal compounds from the cyclohexanone compounds | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1995-12-20 | — | — | EP | disclosed |
| EP-0682031-A1 | Silacyclohexane carbaldehyde compounds and processes for preparing silycyclohexane-based liquid crystal compounds from the carbaldehyde compound | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1995-11-15 | — | — | EP | disclosed |
| WO-1991019698-A1 | 8-LOWER ALKYL-5-CYCLOALKYL OR 5-CYCLOALKENYL SUBSTITUED BENZAZEPINES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | SCHERING CORPORATION (US) | 1991-12-26 | — | — | WO | disclosed |
| JP-S6440477-A | INTERMEDIATE FOR ORGANIC CONDUCTOR AND PRODUCTION THEREOF | TOPPAN PRINTING CO LTD | 1989-02-10 | — | — | JP | disclosed |