Butylamine

Butylamine

SCHEMBL1040345

CCCCN.c1ccc2c(B(c3cccc4ccccc34)c3cccc4ccccc34)cccc2c1

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 4/20 0.45
TLR8 Q9NR97 5/20 0.39
CA12 O43570 1/20 0.39
CA3 P07451 1/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
CA5A P35218 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39
CA5B Q9Y2D0 1/20 0.39
ALDH1A1 P00352 2/20 0.38
HSD17B10 Q99714 2/20 0.38
TSHR P16473 1/20 0.38
RECQL P46063 1/20 0.38
DPP4 P27487 1/20 0.37
SCN1A P35498 2/20 0.37
SCN2A Q99250 2/20 0.37
SCN3A Q9NY46 2/20 0.37
KDM4E B2RXH2 1/20 0.37

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
Tetrabuthylammonium SCHEMBL4938819 0.81 SLC22A1 (0.40) HTR1BALDH1A1KDM4ECYP1A2CYP2C9
SCHEMBL1265002 0.79 ALDH1A1 (0.50) HTR1BCA9ALDH1A1HSD17B10TSHR
SCHEMBL30155141 0.79 ALDH1A1 (0.50) HTR1BCA9ALDH1A1HSD17B10TSHR
Anthracene SCHEMBL11035788 0.77 MEN1 (0.47) HTR1BTLR8ALDH1A1TSHRCYP1A2
Naphthalene SCHEMBL2906117 0.77 DNM1 (0.46) TLR8ALDH1A1TSHR
SCHEMBL14415465 0.77 HTR1B (0.41) HTR1BALDH1A1DPP4KDM4EHTR1D
Butylamine SCHEMBL29837394 0.76 ALDH1A1 (0.43) HTR1BTLR8ALDH1A1HSD17B10TSHR
Butylamine SCHEMBL1146873 0.76 HTR1B (0.57) HTR1BHTR1D
SCHEMBL14853049 0.75 TLR8 (0.50) HTR1BTLR8ALDH1A1HSD17B10TSHR
SCHEMBL5951610 0.75 HTR1B (0.40) HTR1BALDH1A1DPP4KDM4EHTR1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1972439-B1 On-press developable lithographic printing plate precursor FUJIFILM CORP (JP) 2011-01-26 EP disclosed
EP-1653281-B1 NEGATIVE PHOTOSENSITIVE COMPOSITION AND NEGATIVE PHOTOSENSITIVE LITHOGRAPHIC PRINTING PLATE KODAK GRAPHIC COMM JAPAN LTD (JP) 2010-09-29 EP disclosed
US-20080229956-A1 ON-PRESS DEVELOPABLE LITHOGRAPHIC PRINTING PLATE PRECURSOR FUJIFILM CORPORATION (JP) 2008-09-25 US disclosed
EP-1972439-A2 On-press developable lithographic printing plate precursor FUJIFILM Corporation (JP) 2008-09-24 EP disclosed
US-7291438-B2 Negative photosensitive composition and negative photosensitive lithographic printing plate EASTMAN KODAK COMPANY (US) 2007-11-06 US disclosed
US-20060251987-A1 Negative photosensitive composition and negative photosensitive lithographic printing plate KODAK (NEAR EAST) INC. 2006-11-09 US disclosed
EP-1653281-A1 NEGATIVE PHOTOSENSITIVE COMPOSITION AND NEGATIVE PHOTOSENSITIVE LITHOGRAPHIC PRINTING PLATE Kodak Polychrome Graphics Japan Ltd. (JP) 2006-05-03 EP disclosed