Tert-Butanol

Tert-Butanol

SCHEMBL3456548

CC(C)(C)O.CC(C)O.[Zr]

nearest known ligand 0.55

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Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.55
LMNA P02545 1/20 0.55
CYP2C19 P33261 1/20 0.40
MAPK1 P28482 1/20 0.33
TSHR P16473 2/20 0.32
THRB P10828 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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.

Compoundsimilaritytop predictedshared targets
Tert-Butanol SCHEMBL894082 1.00 ALDH1A1 (0.55) ALDH1A1LMNACYP2C19MAPK1TSHR
Tert-Butanol SCHEMBL217036 0.95
Tert-Butanol SCHEMBL17763313 0.95 ALDH1A1 (0.60) ALDH1A1LMNACYP2C19MAPK1TSHR
Tert-Butanol SCHEMBL8647334 0.91 ALDH1A1 (0.55) ALDH1A1LMNACYP2C19MAPK1TSHR
Tert-Butanol SCHEMBL28273931 0.91 ALDH1A1 (0.55) ALDH1A1LMNACYP2C19MAPK1TSHR
Tert-Butanol SCHEMBL28030283 0.91 ALDH1A1 (0.55) ALDH1A1LMNACYP2C19MAPK1TSHR
Tert-Butanol SCHEMBL1134592 0.91 ALDH1A1 (0.55) ALDH1A1LMNACYP2C19MAPK1TSHR
Isopropyl Alcohol SCHEMBL29068742 0.86
Isopropyl Alcohol SCHEMBL22587395 0.82 ALDH1A1 (0.55) ALDH1A1LMNACYP2C19MAPK1TSHR
Tert-Butanol SCHEMBL5867069 0.81 TSHR (0.43) ALDH1A1LMNACYP2C19MAPK1TSHR

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2258998-A2 High performance heat transfer device, methods of manufacture thereof and articles comprising the same General Electric Company (US) 2010-12-08 EP disclosed
US-20100294467-A1 HIGH PERFORMANCE HEAT TRANSFER DEVICE, METHODS OF MANUFACTURE THEREOF AND ARTICLES COMPRISING THE SAME GENERAL ELECTRIC COMPANY (US) 2010-11-25 US disclosed
US-20100294475-A1 HIGH PERFORMANCE HEAT TRANSFER DEVICE, METHODS OF MANUFACTURE THEREOF AND ARTICLES COMPRISING THE SAME GENERAL ELECTRIC COMPANY (US) 2010-11-25 US disclosed
EP-2253919-A2 High Performance Heat Transfer Device, Methods Of Manufacture Thereof And Articles Comprising The Same General Electric Company (US) 2010-11-24 EP disclosed
US-20100129639-A1 SURFACE HAVING A NANOPOROUS COATING, METHODS OF MANUFACTURE THEREOF AND ARTICLES COMPRISING THE SAME GENERAL ELECTRIC COMPANY (US) 2010-05-27 US disclosed