Butylamine

Butylamine

SCHEMBL4367320

CCCCN.OB(O)OCCCC(c1cccc2ccccc12)(c1cccc2ccccc12)c1cccc2ccccc12

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 4/20 0.39
CNR1 P21554 3/20 0.34
CNR2 P34972 3/20 0.34
GAA P10253 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CYP2C9 P11712 1/20 0.33
HTR1D P28221 1/20 0.33
KIF11 P52732 4/20 0.33

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
Butylamine SCHEMBL4543224 0.95 HTR1B (0.37) HTR1BCNR1CNR2GAATDP1
SCHEMBL31516172 0.89 ACP3 (0.35) HTR1BTDP1KIF11
SCHEMBL624788 0.89 ACP3 (0.35) HTR1BTDP1KIF11
Ammonia Solution, Strong SCHEMBL15094349 0.87 ACP3 (0.35) HTR1BTDP1KIF11
Tetrabuthylammonium SCHEMBL5716017 0.87 CNR1 (0.35) HTR1BCNR1CNR2GAATDP1
Tetrylammonium SCHEMBL1146621 0.86 CHRNB4 (0.36) HTR1BCNR1CNR2GAATDP1
Tetramethylammonium Ion SCHEMBL1146977 0.86 ACP3 (0.33) HTR1BTDP1CYP2C9KIF11
SCHEMBL1818271 0.83 KCNA3 (0.35) HTR1BCNR1CNR2TDP1KIF11
Butylamine SCHEMBL4364111 0.80 KIF11 (0.54) CYP2C9KIF11
Butylamine SCHEMBL1768571 0.80 KIF11 (0.54) CYP2C9KIF11

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
US-20090233221-A1 NEGATIVE-WORKING PHOTOSENSITIVE MATERIAL AND NEGATIVE-WORKING PLANOGRAPHIC PRINTING PLATE PRECURSOR FUJIFILM CORPORATION (JP) 2009-09-17 US disclosed