Bromoethane

Bromoethane

SCHEMBL8925398

CC(C)(C)OC(N)=O.CCBr

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.40
LMNA P02545 1/20 0.39
HSD17B10 Q99714 1/20 0.39
DGAT1 O75907 1/20 0.34
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
CA1 P00915 2/20 0.32
CA7 P43166 2/20 0.32
CA12 O43570 1/20 0.32
CA14 Q9ULX7 1/20 0.32
ALDH1A1 P00352 2/20 0.32
TRPA1 O75762 1/20 0.32
CTSK P43235 2/20 0.32
TDP1 Q9NUW8 1/20 0.31
CA2 P00918 1/20 0.31
NOS1 P29475 2/20 0.30
AKT1 P31749 1/20 0.30
NOS3 P29474 1/20 0.30
NOS2 P35228 1/20 0.30
GAA P10253 1/20 0.30

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
N-Propyl Bromide SCHEMBL27943912 0.91 LMNA (0.41) ALOX15LMNAHSD17B10DGAT1MAOA
Propane SCHEMBL27464056 0.90 ALOX15 (0.43) ALOX15LMNAHSD17B10DGAT1MAOA
Butane SCHEMBL27617980 0.87 LMNA (0.45) ALOX15LMNAHSD17B10DGAT1MAOA
Alcohol SCHEMBL6545350 0.87 ALOX15 (0.42) ALOX15LMNAHSD17B10DGAT1MAOA
Ethylamine SCHEMBL5574544 0.87 ALOX15 (0.42) ALOX15LMNAHSD17B10DGAT1MAOA
SCHEMBL28902273 0.87 DGAT1 (0.42) ALOX15LMNAHSD17B10DGAT1MAOA
SCHEMBL28325001 0.87 DGAT1 (0.42) ALOX15LMNAHSD17B10DGAT1MAOA
SCHEMBL3094 0.87
SCHEMBL30234788 0.87 DGAT1 (0.42) ALOX15LMNAHSD17B10DGAT1MAOA
Ethyl Chloride SCHEMBL28678554 0.85 ALOX15 (0.40) ALOX15LMNAHSD17B10DGAT1MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0552368-A1 PROCESS FOR PURIFYING SYNTHETIC PEPTIDE, AND LINKER AND LINKER-COMBINING SOLID-PHASE CARRIER USED IN SAID PROCESS NIHON MILLIPORE KABUSHIKI KAISHA (JP) 1993-07-28 EP claimed
US-5614524-A Piperazine derivatives as 5-HT1 Agonists MERCK SHARP & DOHME LTD. (GB) 1997-03-25 US disclosed
EP-0552368-A1 PROCESS FOR PURIFYING SYNTHETIC PEPTIDE, AND LINKER AND LINKER-COMBINING SOLID-PHASE CARRIER USED IN SAID PROCESS NIHON MILLIPORE KABUSHIKI KAISHA (JP) 1993-07-28 EP disclosed
US-4304715-A Enkephalin analogues HUDSON DEREK 1981-12-08 US disclosed
US-RE30731-E Enkephalin analogues Hudson, Derek (GB) 1981-09-01 US disclosed
US-4198398-A Enkephalin analogues HUDSON DEREK (GB) 1980-04-15 US disclosed