Taurine

Taurine

SCHEMBL4593157

CNC1CCN(C(C)C)CC1.NCCS(=O)(=O)O

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
SLC6A6 P31641 1/20 0.41
CYP2C19 P33261 1/20 0.41
BLM P54132 1/20 0.41
F10 P00742 1/20 0.36
ALDH1A1 P00352 1/20 0.35
ACKR3 P25106 1/20 0.34
HRH3 Q9Y5N1 4/20 0.33
CYP2D6 P10635 1/20 0.33
APP P05067 1/20 0.32
KDM1A O60341 1/20 0.31
MAPT P10636 1/20 0.30
PDE5A O76074 1/20 0.30
EHMT1 Q9H9B1 1/20 0.30

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
Taurine SCHEMBL4593156 0.79 SMN1; SMN2 (0.42) LMNASLC6A6CYP2C19BLMALDH1A1
SCHEMBL220468 0.77 F10 (0.48) F10ALDH1A1ACKR3HRH3CYP2D6
SCHEMBL221799 0.77 KDM1A (0.42) ALDH1A1ACKR3HRH3CYP2D6KDM1A
Hydrochloric Acid SCHEMBL2104255 0.75 KDM1A (0.41) ALDH1A1ACKR3HRH3CYP2D6KDM1A
SCHEMBL4592504 0.74 MAOB (0.49) ALDH1A1KDM1AMAPT
Taurine SCHEMBL4592404 0.73 CYP2C19 (0.36) CYP2C19F10ALDH1A1HRH3KDM1A
SCHEMBL222294 0.72 F10 (0.46) F10ALDH1A1ACKR3HRH3CYP2D6
Fumaric Acid SCHEMBL3873534 0.71 F10 (0.47) F10ALDH1A1ACKR3HRH3CYP2D6
SCHEMBL29346783 0.70 KDM1A (0.38) ALDH1A1HRH3CYP2D6KDM1AMAPT
SCHEMBL19623362 0.70 KDM1A (0.38) ALDH1A1HRH3CYP2D6KDM1AMAPT

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-1888567-A1 HETEROARYL-CARBOXYLIC ACID (SULFAMOYL ALKYL) AMIDE - DERIVATIVES AS FACTOR XA INHIBITORS Sanofi-Aventis (FR) 2008-02-20 EP disclosed
WO-2006122661-A1 HETEROARYL-CARBOXYLIC ACID (SULFAMOYL ALKYL) AMIDE - DERIVATIVES AS FACTOR XA INHIBITORS SANOFI-AVENTIS (DE) 2006-11-23 WO disclosed