Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 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 | |
|---|---|---|---|---|
| SCHEMBL2169435 | 0.81 | — | — | |
| SCHEMBL25290892 | 0.80 | TDP1 (0.38) | TDP1CHRM1AKR1A1CHRM3HTR2A | |
| SCHEMBL2796306 | 0.77 | — | — | |
| Acetic Acid SCHEMBL8816064 | 0.77 | CHRM1 (0.41) | TDP1CHRM1AKR1A1CHRM3HTR2A | |
| SCHEMBL2675052 | 0.77 | GAA (0.43) | TSHRNPSR1ALDH1A1 | |
| SCHEMBL10624735 | 0.72 | NAAA (0.44) | TDP1HTR2CTSHRNPSR1ALDH1A1 | |
| Ethyl Acetate SCHEMBL143986 | 0.72 | ALDH1A1 (0.56) | TDP1CHRM1AKR1A1CHRM3HTR2A | |
| SCHEMBL12518006 | 0.72 | — | — | |
| SCHEMBL107911 | 0.72 | — | — | |
| SCHEMBL446905 | 0.71 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102653777-B | Method for producing acetone-butanol-ethanol (ABE) by virtue of fermentation of wheat bran | SHANGHAI CAS ADVANCED RES INST | 2014-09-10 | — | — | CN | claimed |
| CN-102653777-A | Method for producing acetone-butanol-ethanol (ABE) by virtue of fermentation of wheat bran | SHANGHAI CAS ADVANCED RES INST | 2012-09-05 | — | — | CN | claimed |
| CN-102653777-B | Method for producing acetone-butanol-ethanol (ABE) by virtue of fermentation of wheat bran | SHANGHAI CAS ADVANCED RES INST | 2014-09-10 | — | — | CN | disclosed |
| CN-103772144-A | Method for separating acetone-butanol-ethanol fermentation liquor by pervaporation-rectification coupling | NANJING UNIVERSITY OF TECHNOLOGY | 2014-05-07 | — | — | CN | disclosed |
| CN-103772144-A | Method for separating acetone-butanol-ethanol fermentation liquor by pervaporation-rectification coupling | NANJING UNIVERSITY OF TECHNOLOGY | 2014-05-07 | — | — | CN | disclosed |
| CN-103328642-A | An integrated process for producing biofuels | NESTE OIL OYJ | 2013-09-25 | — | — | CN | disclosed |
| CN-102653777-A | Method for producing acetone-butanol-ethanol (ABE) by virtue of fermentation of wheat bran | SHANGHAI CAS ADVANCED RES INST | 2012-09-05 | — | — | CN | disclosed |
| CN-101959568-A | Reclaim higher alcohol from dilute aqueous solution | GEVO INC | 2011-01-26 | — | — | CN | disclosed |
| CN-101432434-A | Fermentive production of four carbon alcohols | DU PONT (US) | 2009-05-13 | — | — | CN | disclosed |
| WO-2004000233-A2 | ALGAL GDP-MANNOSE-3',5'-EPIMERASES AND METHODS OF USE THEREOF | ARKION LIFE SCIENCES LLC (US) | 2003-12-31 | — | — | WO | disclosed |