Ethane

Ethane

SCHEMBL28119304

CC.NCc1cc(O)c(C2CCCCC2)cc1-c1ccc(O)cc1

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NUDT1 P36639 1/20 0.44
▸ BACE1 P56817 1/20 0.44
▸ ESR2 Q92731 7/20 0.36
▸ ESR1 P03372 6/20 0.36
▸ HSP90AA1 P07900 1/20 0.35
▸ PTGS2 P35354 1/20 0.34
▸ HTR2A P28223 3/20 0.32
▸ MIF P14174 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ USP7 Q93009 1/20 0.32
▸ PABPC1 P11940 1/20 0.31
▸ DRD1 P21728 1/20 0.31
▸ PDE4D Q08499 1/20 0.31
▸ PDE7A Q13946 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
Ethane SCHEMBL27615405 0.88 NUDT1 (0.46) NUDT1BACE1HSP90AA1PTGS2HTR2A
Ethane SCHEMBL28105966 0.82 NUDT1 (0.44) NUDT1BACE1HSP90AA1PTGS2PDE4D
Ethane SCHEMBL28253356 0.82 NUDT1 (0.44) NUDT1BACE1HSP90AA1PTGS2HTR2A
Ethane SCHEMBL28106473 0.79 BACE1 (0.44) NUDT1BACE1HSP90AA1PTGS2HTR2A
SCHEMBL28207069 0.79 NUDT1 (0.41) NUDT1BACE1HSP90AA1HTR2A
Ethane SCHEMBL28252614 0.79 NUDT1 (0.44) NUDT1BACE1HSP90AA1HTR2ADRD1
SCHEMBL3816966 0.78 ESR2 (0.39) NUDT1BACE1ESR2ESR1HSP90AA1
SCHEMBL27548577 0.77 NUDT1 (0.51) NUDT1BACE1ESR2ESR1HSP90AA1
SCHEMBL28269345 0.75 NUDT1 (0.43) NUDT1BACE1ESR2ESR1HSP90AA1
SCHEMBL27474169 0.73 NUDT1 (0.48) NUDT1BACE1HSP90AA1HTR2APABPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103698977-B Photosensitive resin composition, protective film and element with protective film 奇美实业股份有限公司 2017-01-04 — — CN disclosed
Send feedback