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BLAST against human drug target
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CABAMIQUINE
Search structure
Status
Phase 2
Molecule Category
Free-form
Datasets:
Active Pharmaceutical Ingredients
Bioactive chemicals
Agrochemicals
Human Metabolites
Search:
Exact
Similarity
SubStructure
Threshold (%) >=
70
Structure
InChI Key
BENUHBSJOJMZEE-UHFFFAOYSA-N
Smiles
O=C(NCCN1CCCC1)c1cc(-c2ccc(CN3CCOCC3)cc2)nc2ccc(F)cc12
InChI
InChI=1S/C27H31FN4O2/c28-22-7-8-25-23(17-22)24(27(33)29-9-12-31-10-1-2-11-31)18-26(30-25)21-5-3-20(4-6-21)19-32-13-15-34-16-14-32/h3-8,17-18H,1-2,9-16,19H2,(H,29,33)
Pharmacology
EC50(nM)
IC50(nM)
Kd(nM)
Ki(nM)
Inhibition(%)
Plasmodium berghei
5-5
-
-
-
-
Plasmodium falciparum
0.3-24
-
-
-
-
Plasmodium falciparum K1
-
0.22
-
-
-
Plasmodium falciparum NF54
-
0.13
-
-
-
Plasmodium yoelii
1-1
-
-
-
-
CONTENTS
Structure
Pharmacology