Benzylamine

Benzylamine

SCHEMBL8464909

NCc1ccccc1.NCc1ccccc1.O=C(O)C(=O)O

nearest known ligand 0.74

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

OPRM1SLC6A4

The experimentally established mechanism targets of Benzylamine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 3/20 0.74
CYP1A2 P05177 1/20 0.63
CYP2D6 P10635 1/20 0.63
CYP2C9 P11712 1/20 0.63
TSHR P16473 1/20 0.63
CYP2C19 P33261 1/20 0.63
TAAR1 Q96RJ0 2/20 0.54
CES2 O00748 1/20 0.50
CES1 P23141 1/20 0.50
ENPP2 Q13822 1/20 0.50
AKR1B1 P15121 1/20 0.50
MAOB P27338 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
HIF1A Q16665 1/20 0.46
ALDH1A1 P00352 1/20 0.46
ALPI P09923 1/20 0.46
PKM P14618 1/20 0.46
PTGS1 P23219 1/20 0.46
XIAP P98170 1/20 0.46
SLC7A5 Q01650 1/20 0.46

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
Benzylamine SCHEMBL6429492 1.00 LOXL2 (0.74) LOXL2CYP1A2CYP2D6CYP2C9TSHR
Benzylamine SCHEMBL29167055 0.97 LOXL2 (0.70) LOXL2CYP1A2CYP2D6CYP2C9TSHR
Benzylamine SCHEMBL2841167 0.92 LOXL2 (0.78) LOXL2CYP1A2CYP2D6CYP2C9TSHR
Benzylamine SCHEMBL2841170 0.92 LOXL2 (0.78) LOXL2CYP1A2CYP2D6CYP2C9TSHR
Benzylamine SCHEMBL25352130 0.90 LOXL2 (0.74) LOXL2CYP1A2CYP2D6CYP2C9TSHR
Benzylamine SCHEMBL9567530 0.90 LOXL2 (0.74) LOXL2CYP1A2CYP2D6CYP2C9TSHR
Benzylamine SCHEMBL3891720 0.90 LOXL2 (0.74) LOXL2CYP1A2CYP2D6CYP2C9TSHR
Benzylamine SCHEMBL3188490 0.90 LOXL2 (0.74) LOXL2CYP1A2CYP2D6CYP2C9TSHR
Benzylamine SCHEMBL27781209 0.89 LOXL2 (0.93) LOXL2CYP1A2CYP2D6CYP2C9TSHR
Benzylamine SCHEMBL1256239 0.87 LOXL2 (0.70) LOXL2CYP1A2CYP2D6CYP2C9TSHR

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-5911099-A Electroconductiive member and electrophotogrpahic apparatus BRIDGESTONE CORPORATION (JP) 1999-06-08 US disclosed