Benzylamine

Benzylamine

SCHEMBL16584747

NCc1ccccc1.c1ccc(CN2CCCCC2)cc1

nearest known ligand 0.73

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PRMT6 Q96LA8 2/20 0.73
HRH3 Q9Y5N1 3/20 0.63
SIGMAR1 Q99720 3/20 0.63
CYP2D6 P10635 2/20 0.61
CYP2C19 P33261 1/20 0.61
ALDH1A1 P00352 3/20 0.58
CA2 P00918 1/20 0.57
NCF1 P14598 1/20 0.57
CHKA P35790 1/20 0.57
HRH4 Q9H3N8 1/20 0.57
SMN1; SMN2 Q16637 2/20 0.56
TDP1 Q9NUW8 1/20 0.56
KDM4E B2RXH2 1/20 0.55
CYP2C9 P11712 1/20 0.54
HIF1A Q16665 1/20 0.54
LOXL2 Q9Y4K0 1/20 0.54
MC4R P32245 1/20 0.53

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
SCHEMBL1934733 0.90 HRH3 (0.78) PRMT6HRH3CYP2D6CYP2C19ALDH1A1
SCHEMBL109000 0.90 HRH3 (0.78) PRMT6HRH3CYP2D6CYP2C19ALDH1A1
SCHEMBL26532 0.90 SIGMAR1 (0.77) HRH3SIGMAR1CYP2D6CYP2C19ALDH1A1
SCHEMBL8327 0.90 SIGMAR1 (0.77) HRH3SIGMAR1CYP2D6CYP2C19ALDH1A1
SCHEMBL688047 0.90 SIGMAR1 (0.77) HRH3SIGMAR1CYP2D6CYP2C19ALDH1A1
SCHEMBL11585348 0.90 SIGMAR1 (0.77) HRH3SIGMAR1CYP2D6CYP2C19ALDH1A1
SCHEMBL11141692 0.90 SIGMAR1 (0.77) HRH3SIGMAR1CYP2D6CYP2C19ALDH1A1
Hydrochloric Acid SCHEMBL1935722 0.88 HRH3 (0.75) PRMT6HRH3CYP2D6CYP2C19ALDH1A1
Bromide SCHEMBL10730905 0.88 SIGMAR1 (0.74) HRH3SIGMAR1CYP2D6CYP2C19ALDH1A1
Hydrochloric Acid SCHEMBL4774633 0.88 SIGMAR1 (0.74) HRH3SIGMAR1CYP2D6CYP2C19ALDH1A1

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
WO-2015042405-A1 PH SWITCHABLE REAGENTS AND METHODS FOR THEIR USE IMPOSSIBLE FOODS INC. (US) 2015-03-26 WO disclosed