Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA7 | P43166 | 2/20 | 0.48 |
| ▸ | CA9 | Q16790 | 2/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.48 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL8939002 | 0.84 | CA4 (0.47) | CA1CA2CA7CA9CA12 | |
| SCHEMBL28449185 | 0.83 | CA1 (0.48) | CA1CA2CA7CA9CA12 | |
| SCHEMBL8939021 | 0.81 | CA4 (0.43) | CA1CA2CA7CA9CA12 | |
| Pyridine SCHEMBL11205049 | 0.80 | CYP17A1 (0.38) | MAPTKDM4ENPC1RAB9AALDH1A1 | |
| SCHEMBL13992853 | 0.79 | CA12 (0.44) | CA1CA2CA7CA9CA12 | |
| SCHEMBL28442330 | 0.79 | CA1 (0.44) | CA1CA2CA7CA9CA12 | |
| SCHEMBL10706891 | 0.79 | CA1 (0.44) | CA1CA2CA7CA9CA12 | |
| SCHEMBL8938985 | 0.79 | L3MBTL1 (0.43) | TDP1MAPK1MAPTL3MBTL1ALDH1A1 | |
| SCHEMBL11443397 | 0.78 | ALDH1A3 (0.41) | GAAMAPTKDM4ENPSR1ALDH1A1 | |
| SCHEMBL6867317 | 0.77 | ACHE (0.38) | CA1CA2CA7CA9ACHE |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4138428-A | OF ACRYLONITRILE TO 1,4-DICYANOBUTENES, ORGANIC PHOSPHORUS | IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) | 1979-02-06 | — | — | US | claimed |
| US-5498741-A | Alkyl aryl arylphosphonites, process for the preparation thereof and use thereof | HOECHST AKTIENGESELLSCHAFT (DE) | 1996-03-12 | — | — | US | disclosed |
| US-4710545-A | REACTING CROSSLINKED DIVINYLBENZENE-STYRENE COPOLYMER WITH A PHOSPHORUS HALIDE, AROMATIC COMPOUND, WATER AND AN ALCOHOL | ALLIED CORPORATION (US) | 1987-12-01 | — | — | US | disclosed |
| US-4661615-A | DIMERIZATION | ALLIED CORPORATION (US) | 1987-04-28 | — | — | US | disclosed |
| US-4581415-A | DIMERIZATION OF ACRYLONITRILE; CATALYST SELECTIVITY; DURABILITY | ALLIED CORPORATION (US) | 1986-04-08 | — | — | US | disclosed |
| US-4574060-A | Selective conversion of acrylonitrile into 1,4-dicyano-1-butene catalyzed by polymer-bound alkyl diarylphosphinites | ALLIED CORPORATION (US) | 1986-03-04 | — | — | US | disclosed |
| EP-0003897-B1 | PHOSPHINEGOLD(I)SALTS, PROCESS FOR THEIR PREPARATION AND COMPOSITIONS CONTAINING THEM | SMITHKLINE BECKMAN CORPORATION (US) | 1983-05-25 | — | — | EP | disclosed |
| US-4096250-A | ANTI-ARTHRITIC | SMITHKLINE CORPORATION (US) | 1978-06-20 | — | — | US | disclosed |