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.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 SCHEMBL2294091 | 0.87 | — | — | |
| Hydrochloric Acid SCHEMBL4235228 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL6196264 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL6213694 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL6620970 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL852092 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL2761848 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL2283898 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL7168696 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL3277379 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6310237-B1 | REACTIONS OF ALPHA-UNSATURATED CARBOXY ACIDS, ESTERS, AMIDES OR THIOESTERS WITH OF 1.) A LEWIS ACID OR BASE OR 2.) HYDROGEN AND TRANSITION METALS OR THEIR OXIDES, OR 3.) ALKYL ALUMINUMS, ALKYL HYDRIDES, SOLUBLE NICKEL OR PALLADIUM SALTS | UNIROYAL CHEMICAL COMPANY, INC. | 2001-10-30 | — | — | US | claimed |
| US-6147251-A | PREPARATION OF DERIVATIVES OF HALO-BUT-2-ENOIC ACIDS AND ESTERS HIGH IN 2-ENE CONTENT; CATALYST PROMOTERS IN ETHYLENE POLYMERIZATION AND COPOLYMERIZATION | UNIROYAL CHEMICAL COMPANY, INC. (US) | 2000-11-14 | — | — | US | claimed |
| CN-116947912-A | Preparation method of calcipotriol intermediate | 湖北恒安芙林药业股份有限公司 | 2023-10-27 | — | — | CN | disclosed |
| US-6960573-B2 | Vitamin D3 derivative and treating agent for inflammatory respiratory disease using same | TEIJIN LIMITED (JP) | 2005-11-01 | — | — | US | disclosed |
| US-6867313-B2 | Vitamin D3 derivative and treating agent for inflammatory respiratory disease using same | TEIJIN LIMITED (JP) | 2005-03-15 | — | — | US | disclosed |
| EP-0970948-B1 | VITAMIN D 3? DERIVATIVES AND REMEDIES FOR INFLAMMATORY RESPIRATORY DISEASES PREPARED FROM THE SAME | TEIJIN LTD (JP) | 2005-03-09 | — | — | EP | disclosed |
| US-6689766-B2 | ALSO FOR TREATING MALIGNANT TUMORS, RHEUMATOID ARTHRITIS, OSTEOPOROSIS, DIABETES MELLITUS, HYPERTENSION, ALOPECIA, ACNE, PSORIASIS, DERMATITIS, HYPERCALCEMIA, HYPOPARATHYROIDISM AND METABOLIC DISORDER OF CARTILAGE. | TEIJIN LIMITED (JP) | 2004-02-10 | — | — | US | disclosed |
| US-6548489-B2 | Also for treating malignant tumors, rheumatoid arthritis, osteoporosis, diabetes mellitus, hypertension, alopecia, acne, psoriasis, dermatitis, hypercalcemia, hypoparathyroidism and metabolic disorder of cartilage. | TEIJIN LIMITED (JP) | 2003-04-15 | — | — | US | disclosed |
| US-20020132799-A1 | Vitamin D3 dervative and treating agent for inflammatory respiratory disease using same | TEIJIN LIMITED | 2002-09-19 | — | — | US | disclosed |
| CN-1090180-C | Vitamin D3 derivatives and remedies for inflammatory respiratory disease | TEIJIN LTD (JP) | 2002-09-04 | — | — | CN | disclosed |
| US-20020103173-A1 | Vitamin D3 derivative and treating agent for inflammatory respiratory disease using same | TEIJIN LIMITED | 2002-08-01 | — | — | US | disclosed |
| US-20020099039-A1 | Vitamin D3 derivative and treating agent for inflammatory respiratory disease using same | TEIJIN LIMITED | 2002-07-25 | — | — | US | disclosed |
| US-20020091109-A1 | Vitamin D3 derivative and treating agent for inflammatory respiratory disease using same | TEIJIN LIMITED | 2002-07-11 | — | — | US | disclosed |
| US-6310237-B1 | REACTIONS OF ALPHA-UNSATURATED CARBOXY ACIDS, ESTERS, AMIDES OR THIOESTERS WITH OF 1.) A LEWIS ACID OR BASE OR 2.) HYDROGEN AND TRANSITION METALS OR THEIR OXIDES, OR 3.) ALKYL ALUMINUMS, ALKYL HYDRIDES, SOLUBLE NICKEL OR PALLADIUM SALTS | UNIROYAL CHEMICAL COMPANY, INC. | 2001-10-30 | — | — | US | disclosed |
| EP-1123921-A1 | VITAMIN D 3? DERIVATIVES AND REMEDIES FOR INFLAMMATORY RESPIRATORY DISEASES CONTAINING THE SAME | TEIJIN LIMITED (JP) | 2001-08-16 | — | — | EP | disclosed |
| US-6147251-A | PREPARATION OF DERIVATIVES OF HALO-BUT-2-ENOIC ACIDS AND ESTERS HIGH IN 2-ENE CONTENT; CATALYST PROMOTERS IN ETHYLENE POLYMERIZATION AND COPOLYMERIZATION | UNIROYAL CHEMICAL COMPANY, INC. (US) | 2000-11-14 | — | — | US | disclosed |
| US-6028208-A | TREATING MALIGNANT TUMORS, RHEUMATOID ARTHRITIS, OSTEOPOROSIS, DIABETES MELLITUS, HYPERTENSION, ALOPECIA, ACNE, PSORIASIS AND DERMATITIS | TEIJIN LIMITED (JP) | 2000-02-22 | — | — | US | disclosed |
| EP-0970948-A1 | VITAMIN D 3? DERIVATIVES AND REMEDIES FOR INFLAMMATORY RESPIRATORY DISEASES PREPARED FROM THE SAME | TEIJIN LIMITED (JP) | 2000-01-12 | — | — | EP | disclosed |
| CN-1236360-A | Vitamin D3Derivatives and therapeutic agents for inflammatory respiratory diseases | TEIJIN LTD (JP) | 1999-11-24 | — | — | CN | disclosed |