Brief Information of the Cell Line and Protein
Cell Line ID: CL000111 , MDA-MB-231
 Cell Line Info 
Synonyms
MDA_MB_231
MDA-MB 231
MDA.MB.231
MDA MB 231
MDA MB231
MDA Mb231
MDA-MB231
MDAMB-231
MDAMB231
MDA-231
MDA-231P
MDA231
MDA231-BRE
MB231
MD Anderson-Metastatic Breast-231
Category Cancer cell line
Organism
Homo sapiens (Human)
Cellosaurus ID
CVCL_0062
Protein ID: PT06082 , Integrin alpha-3
 Protein Info 
Gene Name ITGA3
Organism Homo sapiens, Human
Protein Classification Membrane receptor
Uniprot ID P26006
Table of Molecular Bioactivities Related to the Cell Line and Protein
Cell Line ID: CL000111
 Cell Line Info 
 Protein ID: PT06082
 Protein Info 
 
Compound ID Compound Name Compound Formula
CP0908229
 Compound Info 
2-((3S,6R,11R,14R,20S,28aS)-11-amino-3-(2-amino-2-oxoethyl)-6-carbamoyl-27-hydroxy-20-(4-hydroxy-3-nitrobenzyl)-1,4,12,15,18,21,24-heptaoxohexacosahydropyrrolo[2,1-j][1,2,5,8,11,14,17,20,23]dithiaheptaazacyclohexacosin-14-yl)acetic acid
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C32H43N11O15S2
  1
1
IC50 = 57 nM
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CP0891937
 Compound Info 
2-((3S,6R,11R,14R,20S,28aS)-11-amino-6-carbamoyl-27-hydroxy-20-(4-hydroxy-3-nitrobenzyl)-3-((R)-1-hydroxyethyl)-1,4,12,15,18,21,24-heptaoxohexacosahydropyrrolo[2,1-j][1,2,5,8,11,14,17,20,23]dithiaheptaazacyclohexacosin-14-yl)acetic acid
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C32H44N10O15S2
  1
1
IC50 = 68 nM
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CP0891938
 Compound Info 
2-((3S,6R,11R,14R,20S,28aS)-11-amino-6-carbamoyl-27-hydroxy-20-(4-hydroxy-3-nitrobenzyl)-3-(2-hydroxyethyl)-1,4,12,15,18,21,24-heptaoxohexacosahydropyrrolo[2,1-j][1,2,5,8,11,14,17,20,23]dithiaheptaazacyclohexacosin-14-yl)acetic acid
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C32H44N10O15S2
  1
1
IC50 = 190 nM
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CP0851243
 Compound Info 
2-((3S,6R,11R,14R,20S,28aS)-11-amino-6-carbamoyl-20-(3-chlorobenzyl)-27-hydroxy-3-((R)-1-hydroxyethyl)-1,4,12,15,18,21,24-heptaoxohexacosahydropyrrolo[2,1-j][1,2,5,8,11,14,17,20,23]dithiaheptaazacyclohexacosin-14-yl)acetic acid
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C32H44ClN9O12S2
  1
1
IC50 = 220 nM
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CP0373938
 Compound Info 
2-((3S,6R,11R,14R,20S,28aS)-11-amino-6-carbamoyl-20-(cyclohexylmethyl)-3-methyl-1,4,12,15,18,21,24-heptaoxohexacosahydropyrrolo[2,1-j][1,2,5,8,11,14,17,20,23]dithiaheptaazacyclohexacosin-14-yl)acetic acid
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C31H49N9O10S2
  1
1
IC50 = 290 nM
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CP0890954
 Compound Info 
2-((3S,6R,11R,14R,20S,28aS)-11-amino-6-carbamoyl-20-(cyclohexylmethyl)-27-hydroxy-1,4,12,15,18,21,24-heptaoxo-3-phenethylhexacosahydropyrrolo[2,1-j][1,2,5,8,11,14,17,20,23]dithiaheptaazacyclohexacosin-14-yl)acetic acid
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C38H55N9O11S2
  1
1
IC50 = 340 nM
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CP0635703
 Compound Info 
2-((3S,6R,11R,14R,20S,28aS)-11-amino-3-(2-amino-2-oxoethyl)-6-carbamoyl-27-hydroxy-20-isobutyl-1,4,12,15,18,21,24-heptaoxohexacosahydropyrrolo[2,1-j][1,2,5,8,11,14,17,20,23]dithiaheptaazacyclohexacosin-14-yl)acetic acid
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C29H46N10O12S2
  2
1
IC50 = 550 nM
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2
Kd = 400 nM
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