Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.38 |
| ▸ | GALR3 | O60755 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | LAP3 | P28838 | 3/20 | 0.35 |
| ▸ | PGD | P52209 | 2/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | MMP1 | P03956 | 1/20 | 0.32 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
| ▸ | MMP8 | P22894 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Butane SCHEMBL6132141 | 0.91 | TSHR (0.42) | TSHRCHRM2CHRM4CHRM1TBXA2R | |
| SCHEMBL9175195 | 0.89 | TSHR (0.41) | TSHRCHRM2CHRM4CHRM1TBXA2R | |
| SCHEMBL27998922 | 0.84 | TSHR (0.50) | TSHRCHRM2CHRM4CHRM1TBXA2R | |
| SCHEMBL28808732 | 0.84 | TSHR (0.50) | TSHRCHRM2CHRM4CHRM1TBXA2R | |
| SCHEMBL28076513 | 0.77 | CA4 (0.40) | TSHRCHRM2CHRM4CHRM1MAPT | |
| SCHEMBL20490108 | 0.77 | LAP3 (0.33) | TSHRLAP3CA12CA1CA2 | |
| SCHEMBL94437 | 0.77 | TSHR (0.42) | TSHRLAP3ALDH1A1 | |
| SCHEMBL3789970 | 0.76 | TSHR (0.46) | TSHRCHRM2CHRM4CHRM1TBXA2R | |
| Phosphoric Acid SCHEMBL31116688 | 0.76 | TSHR (0.78) | TSHRCHRM2CHRM4CHRM1TBXA2R | |
| SCHEMBL9163310 | 0.75 | TSHR (0.46) | TSHRCHRM2CHRM4CHRM1TBXA2R |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0658563-B1 | Process for preparing dialkyl esters of vinylphosphonic acid | CLARIANT GMBH (DE) | 1999-09-01 | — | — | EP | claimed |
| US-5475128-A | Continuous processing; recirculating catalyst liquid media via an evaporator | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-12-12 | — | — | US | claimed |
| US-5391815-A | Solvent extraction with alcohol, ketone or mixture | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-02-21 | — | — | US | claimed |
| EP-0281122-B1 | PROCESS FOR PREPARING VINYLPHOSPHONIC-ACID DIALKYL ESTERS | HOECHST AKTIENGESELLSCHAFT (DE) | 1991-05-15 | — | — | EP | claimed |
| JP-7258279-A | — | — | None | — | — | JP | disclosed |
| US-5475128-A | Continuous processing; recirculating catalyst liquid media via an evaporator | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-12-12 | — | — | US | disclosed |
| US-5475128-A | Continuous processing; recirculating catalyst liquid media via an evaporator | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-12-12 | — | — | US | disclosed |
| JP-H07258279-A | PREPARATION OF DIALKYL VINYLPHOSPHONATE | HOECHST AG | 1995-10-09 | — | — | JP | disclosed |
| US-5391815-A | Solvent extraction with alcohol, ketone or mixture | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-02-21 | — | — | US | disclosed |
| US-5132444-A | Converting haloethane-, hydroxyethane- or esterified hydroxyethanephosphonic ester; solid catalyst consisting of phosphate, acid oxide or acid oxide support impregnated with acidic substance, alkali metal oxide or alkaline earth oxide | BASF AKTIENGESELLSCHAFT (DE) | 1992-07-21 | — | — | US | disclosed |
| US-4894470-A | Process for the preparation of dialkyl vinylphosphonates | HOECHST AKTIENGESELLSCHAFT (DE) | 1990-01-16 | — | — | US | disclosed |
| US-4608207-A | Dialkyl 2-alkylcarbonatoethanephosphonates | BAYER AKTIENGESELLSCHAFT (DE) | 1986-08-26 | — | — | US | disclosed |
| EP-0124819-B1 | 2-ALKYLCARBONATOETHANEPHOSPHONIC-ACID DIALKYL ESTERS AND THEIR USE IN PREPARING VINYLPHOSHONIC-ACID DIALKYL ESTERS | BAYER AG (DE) | 1986-08-06 | — | — | EP | disclosed |
| EP-0124819-A1 | 2-Alkylcarbonatoethanephosphonic-acid dialkyl esters and their use in preparing vinylphoshonic-acid dialkyl esters | BAYER AG (DE) | 1984-11-14 | — | — | EP | disclosed |