Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Butane. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR3 | O14843 | 2/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | CDC25A | P30304 | 6/20 | 0.35 |
| ▸ | CDC25B | P30305 | 6/20 | 0.35 |
| ▸ | CDC25C | P30307 | 5/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | HRH1 | P35367 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.32 |
| ▸ | CES2 | O00748 | 1/20 | 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 | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL18685960 | 0.84 | CA1 (0.36) | FFAR3 | |
| Bicarbonate SCHEMBL9492587 | 0.81 | CA1 (0.39) | — | |
| Benzene SCHEMBL626626 | 0.78 | CA9 (0.36) | TDP1CES2CES1TSHRALDH1A1 | |
| Butane SCHEMBL1329645 | 0.77 | FFAR3 (0.54) | FFAR3HDAC1HDAC2HDAC3HDAC8 | |
| Butane SCHEMBL40275 | 0.77 | FFAR3 (0.54) | FFAR3HDAC1HDAC2HDAC3HDAC8 | |
| Butane SCHEMBL1165212 | 0.77 | FFAR3 (0.54) | FFAR3HDAC1HDAC2HDAC3HDAC8 | |
| Butane SCHEMBL1716773 | 0.77 | — | — | |
| Butane SCHEMBL21633593 | 0.77 | FFAR3 (0.54) | FFAR3HDAC1HDAC2HDAC3HDAC8 | |
| Butane SCHEMBL28409881 | 0.77 | FFAR3 (0.54) | FFAR3HDAC1HDAC2HDAC3HDAC8 | |
| Butane SCHEMBL28896048 | 0.77 | FFAR3 (0.54) | FFAR3HDAC1HDAC2HDAC3HDAC8 |
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 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2787024-B1 | Thermosetting composition, hardened film and electronic component | JNC CORP (JP) | 2017-04-05 | — | — | EP | claimed |
| EP-1771141-B1 | DENTAL ADHESIVE COMPOSITION | DENTSPLY DETREY GMBH (DE) | 2009-03-25 | — | — | EP | claimed |
| EP-1336636-B1 | Liquid crystal aligning agent,method of forming a liquid crystal alignment film and liquid crystal display element | JSR CORP (JP) | 2006-05-03 | — | — | EP | claimed |
| EP-0840161-B1 | LIQUID CRYSTAL ALIGNING AGENT | JSR CORP (JP) | 2005-04-06 | — | — | EP | claimed |
| EP-0718666-B1 | Liquid crystal-aligning agent | JSR CORP (JP) | 2003-03-26 | — | — | EP | claimed |
| EP-0714913-A1 | Swellable starch ester, process for its preparation and its use | DEGUSSA AKTIENGESELLSCHAFT (DE) | 1996-06-05 | — | — | EP | claimed |
| EP-0523240-B1 | BISIMIDE COMPOUNDS, POLYIMIDE RESIN COMPOSITION PREPARED THEREFROM, AND CARBON FIBER-REINFORCED POLYIMIDE RESIN COMPOSITION | MITSUI TOATSU CHEMICALS (JP) | 1996-03-20 | — | — | EP | claimed |
| EP-0249881-B1 | LIQUID CRYSTAL ALIGNING AGENT | NISSAN CHEMICAL INDUSTRIES LTD. (JP) | 1990-10-03 | — | — | EP | claimed |
| EP-2986657-A2 | ALKOXYSILYL-CONTAINING ADHESIVE SEALANTS WITH INTRINSICALLY REDUCED VISCOSITY | Evonik Degussa GmbH (DE) | 2016-02-24 | — | — | EP | disclosed |
| WO-2014170072-A2 | ALKOXYSILYL-CONTAINING ADHESIVE SEALANTS WITH INTRINSICALLY REDUCED VISCOSITY | EVONIK INDUSTRIES AG (DE) | 2014-10-23 | — | — | WO | disclosed |
| EP-2576650-A1 | MATERIALS, PROCESS FOR PRODUCTION THEREOF AND COMPONENTS THEREFOR | BASF SE (DE) | 2013-04-10 | — | — | EP | disclosed |
| WO-2012163680-A1 | THERMOPLASTIC MOLDING COMPOUND | BASF SE (DE) | 2012-12-06 | — | — | WO | disclosed |
| WO-2011147723-A1 | MATERIALS, PROCESS FOR PRODUCTION THEREOF AND COMPONENTS THEREFOR | BASF SE (DE) | 2011-12-01 | — | — | WO | disclosed |
| EP-0687278-B1 | POLYMERS CONTAINING POLYACETAL BLOCKS, METHOD OF PRODUCING THEM AND THEIR USE | BASF AG (DE) | 1997-05-02 | — | — | EP | disclosed |
| EP-0136528-A2 | Process for the preparation of polyamide imides and their use | BAYER AG (DE) | 1985-04-10 | — | — | EP | disclosed |
| EP-0136526-A2 | Process for the preparation of polyamide imides | BAYER AG (DE) | 1985-04-10 | — | — | EP | disclosed |
| EP-0112528-A2 | Process for the production of hydantoin esters | BAYER AG (DE) | 1984-07-04 | — | — | EP | disclosed |
| EP-0104417-A2 | Process for preparing polyamide-imides | BAYER AG (DE) | 1984-04-04 | — | — | EP | disclosed |
| EP-0025554-B1 | PRECONDENSED HEAT-CURABLE AQUEOUS VARNISH-COATING COMPOSITION AND APPLICATION THEREOF TO THE CATHODIC ELECTRODEPOSITION ON ELECTRO-CONDUCTIVE SUBSTRATES | Herberts Gesellschaft mit beschränkter Haftung (DE) | 1983-05-04 | — | — | EP | disclosed |
| EP-0025554-A2 | Precondensed heat-curable aqueous varnish-coating composition and application thereof to the cathodic electrodeposition on electro-conductive substrates | Herberts Gesellschaft mit beschränkter Haftung (DE) | 1981-03-25 | — | — | EP | disclosed |