SET PAGESIZE 100;
COLUMN ACTIVITY HEADING ActivityKeywds FORMAT A20;
COLUMN DXRN HEADING DXRN FORMAT A20;
COLUMN SMILES HEADING SMILES FORMAT A20;
SELECT DISTINCT ACTIVITY,WDI.DXRN,SMILES
FROM WDI
WHERE exact(SMILES,smi2cansmi('CNC(=C[N+](=O)[O-])NCCSCc1ccc(CN(C)C)o1',0))=1;
QUIT;
SQL*Plus: Release 8.1.5.0.0 - Production on Mon Aug 20 07:49:49 2001
(c) Copyright 1999 Oracle Corporation. All rights reserved.
Connected to:
Oracle8i Enterprise Edition Release 8.1.5.0.2 - Production
With the Partitioning and Java options
PL/SQL Release 8.1.5.0.0 - Production
ActivityKeywds DXRN SMILES
-------------------- -------------------- --------------------
ANTIHISTAMINES-H2; G RANITIDIN CNC(=C[N+](=O)[O-])N
ASTRIC-SECRETION-INH CCSCc1ccc(CN(C)C)o1
IBITORS; ANTIULCERS
TRIAL-PREP.; ANTIHIS DR9500269 CNC(=C[N+](=O)[O-])N
TAMINES-H2; GASTRIC- CCSCc1ccc(CN(C)C)o1
SECRETION-INHIBITORS
Disconnected from Oracle8i Enterprise Edition Release 8.1.5.0.2 - Production
With the Partitioning and Java options
PL/SQL Release 8.1.5.0.0 - Production
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