Propylamine

Propylamine

SCHEMBL9060342

CCCN.c1ccc(B(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.45
MEN1 O00255 1/20 0.45
TRPM2 O94759 1/20 0.45
ALDH1A1 P00352 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
THRB P10828 1/20 0.45
HPGD P15428 1/20 0.45
ALOX15 P16050 1/20 0.45
TSHR P16473 1/20 0.45
ALOX12 P18054 1/20 0.45
MAPK1 P28482 1/20 0.45
KMT2A Q03164 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
PCSK9 Q8NBP7 2/20 0.43
TAAR1 Q96RJ0 5/20 0.39
LOXL2 Q9Y4K0 2/20 0.39
CYP2A6 P11509 1/20 0.39
HTR2A P28223 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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 SCHEMBL1039730 0.89 PCSK9 (0.48) KDM4EMEN1TRPM2ALDH1A1CYP1A2
Ethylenediamine SCHEMBL7559944 0.87 KDM4E (0.56) KDM4EMEN1TRPM2ALDH1A1CYP1A2
Tetradecylamine SCHEMBL9777222 0.85 DNM1 (0.52) MEN1ALDH1A1TSHRKMT2APCSK9
SCHEMBL7564288 0.85 DNM1 (0.52) MEN1ALDH1A1TSHRKMT2APCSK9
Octadecylamine SCHEMBL1870630 0.85 DNM1 (0.52) MEN1ALDH1A1TSHRKMT2APCSK9
Hexadecylamine SCHEMBL7557540 0.85 DNM1 (0.52) MEN1ALDH1A1TSHRKMT2APCSK9
Dodecylamine SCHEMBL1880529 0.85 DNM1 (0.52) MEN1ALDH1A1TSHRKMT2APCSK9
Methylamine SCHEMBL9777145 0.81 ORAI1 (0.45) KDM4EMEN1TRPM2ALDH1A1CYP1A2
SCHEMBL8081505 0.80 MAOA (0.50) KDM4EMEN1TRPM2ALDH1A1CYP1A2
Monoethanolamine SCHEMBL8849863 0.80 TSHR (0.45) KDM4EMEN1TRPM2ALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-8311074-A None JP disclosed
JP-H08311074-A PRODUCTION OF TRIPHENYLBORANE-AMINE COMPLEX COMPOUND YOSHITOMI PHARMACEUT IND LTD 1996-11-26 JP disclosed