Dimethylamine

Dimethylamine

SCHEMBL7705458

CNC.COC(=O)CCCCCNS(=O)(=O)c1ccc(N=Nc2ccccc2)cc1

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.56
TBXA2R P21731 1/20 0.55
HDAC1 Q13547 1/20 0.55
HDAC2 Q92769 1/20 0.55
PKM P14618 3/20 0.52
LMNA P02545 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.50
KDM4E B2RXH2 1/20 0.50
RAB9A P51151 2/20 0.48
MEN1 O00255 1/20 0.48
MAPT P10636 1/20 0.48
KMT2A Q03164 1/20 0.48
MAPK1 P28482 1/20 0.47
HTT P42858 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
Dimethylamine SCHEMBL7699289 0.95 ALDH1A1 (0.61) ALDH1A1TBXA2RHDAC1HDAC2PKM
SCHEMBL31522332 0.86 ALDH1A1 (0.73) ALDH1A1TBXA2RHDAC1HDAC2PKM
SCHEMBL1403259 0.86 ALDH1A1 (0.73) ALDH1A1TBXA2RHDAC1HDAC2PKM
SCHEMBL31522327 0.86 ALDH1A1 (0.73) ALDH1A1TBXA2RHDAC1HDAC2PKM
SCHEMBL7705147 0.85 ALDH1A1 (0.51) ALDH1A1TBXA2RHDAC1HDAC2PKM
Dimethylamine SCHEMBL7704681 0.81 RAB9A (0.57) ALDH1A1TBXA2RHDAC1HDAC2PKM
SCHEMBL28147718 0.81 ALDH1A1 (0.71) ALDH1A1TBXA2RHDAC1HDAC2PKM
SCHEMBL7699286 0.80 ALDH1A1 (0.54) ALDH1A1PKMLMNASMN1; SMN2KDM4E
SCHEMBL7701432 0.80 ALDH1A1 (0.54) ALDH1A1PKMLMNASMN1; SMN2KDM4E
SCHEMBL13223680 0.80 ALDH1A1 (0.69) ALDH1A1PKMLMNARAB9AMAPT

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
EP-1208109-A2 NUCLEOSIDE ANALOGUES NYCOMED AMERSHAM PLC (GB) 2002-05-29 EP disclosed
WO-2001016150-A2 NUCLEOSIDE ANALOGUES AMERSHAM PLC (GB) 2001-03-08 WO disclosed