Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 1/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | ACP3 | P15309 | 1/20 | 0.42 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.40 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.39 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.39 |
| ▸ | PNMT | P11086 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 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 | |
|---|---|---|---|---|
| SCHEMBL17864868 | 0.84 | HDAC4 (0.38) | AOC3 | |
| SCHEMBL3096347 | 0.81 | AOC3 (0.56) | AOC3SLC6A2SLC6A4SLC6A3ACP3 | |
| SCHEMBL11395224 | 0.81 | AOC3 (0.51) | AOC3SLC6A2SLC6A4SLC6A3ACP3 | |
| SCHEMBL6204741 | 0.79 | AOC3 (0.50) | AOC3SLC6A2SLC6A4SLC6A3ACP3 | |
| SCHEMBL16953022 | 0.79 | AOC3 (0.50) | AOC3SLC6A2SLC6A4SLC6A3ACP3 | |
| SCHEMBL10861290 | 0.79 | AOC3 (0.42) | AOC3SLC6A2SLC6A4SLC6A3ACP3 | |
| SCHEMBL6204740 | 0.79 | AOC3 (0.50) | AOC3SLC6A2SLC6A4SLC6A3ACP3 | |
| SCHEMBL6155751 | 0.78 | AOC3 (0.45) | AOC3SLC6A2SLC6A4SLC6A3ACP3 | |
| SCHEMBL11403406 | 0.77 | TSHR (0.42) | AOC3SLC6A4TSHR | |
| SCHEMBL24615882 | 0.76 | AOC3 (0.64) | AOC3SLC6A2SLC6A4SLC6A3ACP3 |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104230879-B | A kind of 2-((4R, 6S)-6-formoxyl-2,2-disubstituted-1,3-dioxane-4-base) acetas preparation method | 新发药业有限公司 | 2016-08-24 | — | — | CN | disclosed |
| CN-105722823-A | NOVEL CYTOCHROME P450 INHIBITORS AND THEIR METHOD OF USE | 科尔泰多公众股份公司 | 2016-06-29 | — | — | CN | disclosed |
| CN-104230879-A | Simple and convenient preparation method of 2-((4R,6S)-6-formyl-2,2-disubstituted-1,3-dioxane-4-yl)acetate | XINFA PHARMACEUTICAL CO LTD | 2014-12-24 | — | — | CN | disclosed |
| EP-1506175-A1 | N-SUBSTITUTED TRICYCLIC 3-AMINOPYRAZOLES AS PDGF RECEPTOR INHIBITORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2005-02-16 | — | — | EP | disclosed |
| WO-2003097609-A1 | N-SUBSTITUTED TRICYCLIC 3-AMINOPYRAZOLES AS PDFG RECEPTOR INHIBITORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2003-11-27 | — | — | WO | disclosed |
| EP-0918757-A1 | 8-HYDROCARBYL SUBSTITUTED BENZODIZOCINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS PROTEIN KINASE C (=PKC) MODULATORS | GEORGETOWN UNIVERSITY (US) | 1999-06-02 | — | — | EP | disclosed |
| WO-1997043268-A1 | 8-HYDROCARBYL SUBSTITUTED BENZODIZOCINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS PROTEIN KINASE C (=PKC) MODULATORS | GEORGETOWN UNIVERSITY (US) | 1997-11-20 | — | — | WO | disclosed |
| US-4629737-A | HYPOGLYCEMIC AGENTS; DIETETICS | BEECHAM GROUP P.L.C. (GB) | 1986-12-16 | — | — | US | disclosed |
| EP-0099707-B1 | 2-AMINOETHYL ETHER DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | BEECHAM GROUP PLC (GB) | 1986-12-10 | — | — | EP | disclosed |
| EP-0099707-A1 | 2-Aminoethyl ether derivatives, processes for their preparation and pharmaceutical compositions containing them | BEECHAM GROUP PLC (GB) | 1984-02-01 | — | — | EP | disclosed |
| US-4246021-A | Imidazole derivatives | MAY & BAKER LIMITED (GB) | 1981-01-20 | — | — | US | disclosed |