Brief Information of the Cell Line and Protein
Cell Line ID: CL000064 , Chem-1
Synonyms
ChemiSCREEN Chem-1
Wild-type control Chem-1 cell line
ChemiSCREEN Chem-1 parental cell line
Category Undefined cell line type
Organism
Rattus norvegicus (Rat)
Cellosaurus ID
CVCL_L474
Protein ID: PT02059 , C-X-C chemokine receptor type 4
Gene Name CXCR4
Organism Homo sapiens, Human
Protein Classification Membrane receptor
Uniprot ID P61073
Table of Molecular Bioactivities Related to the Cell Line and Protein
Cell Line ID: CL000064  Protein ID: PT02059
 
Compound ID Compound Name Compound Formula
CP0489179
N-(pyridin-2-ylmethyl)-N'-[[(3R)-1,2,3,4-tetrahydroisoquinolin-3-yl]methyl]-N'-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]butane-1,4-diamine
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C29H37N5
 1
1
IC50 = 1 nM
   TI
   LI
   LO
   TS
CP0406572
N'-[[(2S)-4-(4-chlorophenyl)sulfonylpiperazin-2-yl]methyl]-N'-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]butane-1,4-diamine
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C24H34ClN5O2S
 1
1
IC50 = 2 nM
   TI
   LI
   LO
   TS
CP0416320
[(3S)-3-[[4-aminobutyl-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]amino]methyl]piperazin-1-yl]-phenylmethanone
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C25H35N5O
 1
1
IC50 = 2 nM
   TI
   LI
   LO
   TS
CP0563754
N'-[[(2S)-4-(benzenesulfonyl)piperazin-2-yl]methyl]-N'-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]butane-1,4-diamine
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C24H35N5O2S
 1
1
IC50 = 2 nM
   TI
   LI
   LO
   TS
CP0070322
N'-[[(3R)-1,2,3,4-tetrahydroisoquinolin-3-yl]methyl]-N'-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]butane-1,4-diamine
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C23H32N4
 2
1
IC50 = 3 nM
   TI
   LI
   LO
   TS
2
IC50 = 120 nM
   TI
   LI
   LO
   TS
CP0484544
4-[[(3R)-1,2,3,4-tetrahydroisoquinolin-3-yl]methyl-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]amino]butylurea
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C24H33N5O
 1
1
IC50 = 3 nM
   TI
   LI
   LO
   TS
CP0471105
N-[4-[[(3R)-1,2,3,4-tetrahydroisoquinolin-3-yl]methyl-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]amino]butyl]acetamide
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C25H34N4O
 1
1
IC50 = 4 nM
   TI
   LI
   LO
   TS
CP0141162
[(3R)-3-[[4-aminobutyl-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]amino]methyl]piperazin-1-yl]-phenylmethanone
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C25H35N5O
 1
1
IC50 = 6 nM
   TI
   LI
   LO
   TS
CP0445507
N-propan-2-yl-N'-[[(3R)-1,2,3,4-tetrahydroisoquinolin-3-yl]methyl]-N'-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]butane-1,4-diamine
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C26H38N4
 1
1
IC50 = 7 nM
   TI
   LI
   LO
   TS
CP0069850
(6,6-dimethyl-5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)methyl N,N'-dicyclohexylimidothiocarbamate
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C21H34N4S2
 1
1
IC50 = 7.4 nM
   TI
   LI
   LO
   TS
CP0466954
N,N-dimethyl-N'-[[(3R)-1,2,3,4-tetrahydroisoquinolin-3-yl]methyl]-N'-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]butane-1,4-diamine
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C25H36N4
 1
1
IC50 = 8 nM
   TI
   LI
   LO
   TS
CP0444193
(6,6-dimethyl-5H-imidazo[2,1-b][1,3]thiazol-3-yl)methyl N'-[4-[[[2-[2-[6-[[2-[2-[[(4R,4aS,7R,7aR,12bS)-3-(cyclopropylmethyl)-4a,9-dihydroxy-1,2,4,5,6,7,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl]amino]-2-oxoethoxy]acetyl]amino]hexylamino]-2-oxoethoxy]acetyl]amino]methyl]cyclohexyl]-N-cyclohexylcarbamimidothioate
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C56H83N9O9S2
 1
1
IC50 = 17.2 nM
   TI
   LI
   LO
   TS
CP0416321
benzyl (3S)-3-[[4-aminobutyl-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]amino]methyl]piperazine-1-carboxylate
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C26H37N5O2
 1
1
IC50 = 18 nM
   TI
   LI
   LO
   TS
CP0099464
N'-[[(2R)-4-(benzenesulfonyl)piperazin-2-yl]methyl]-N'-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]butane-1,4-diamine
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C24H35N5O2S
 1
1
IC50 = 23 nM
   TI
   LI
   LO
   TS
CP0431549
[(3R)-3-[[4-aminobutyl-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]amino]methyl]piperazin-1-yl]-(furan-2-yl)methanone
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C23H33N5O2
 1
1
IC50 = 35 nM
   TI
   LI
   LO
   TS
CP0387864
N'-[[(3R)-2-methyl-3,4-dihydro-1H-isoquinolin-3-yl]methyl]-N'-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]butane-1,4-diamine
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C24H34N4
 1
1
IC50 = 39 nM
   TI
   LI
   LO
   TS
CP0559064
N'-[[(2S)-4-(1-benzothiophen-2-ylsulfonyl)piperazin-2-yl]methyl]-N'-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]butane-1,4-diamine
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C26H35N5O2S2
 1
1
IC50 = 39 nM
   TI
   LI
   LO
   TS
CP0444196
N'-[[(3R)-2-(pyridin-2-ylmethyl)-3,4-dihydro-1H-isoquinolin-3-yl]methyl]-N'-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]butane-1,4-diamine
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C29H37N5
 1
1
IC50 = 56 nM
   TI
   LI
   LO
   TS
CP0425036
N'-[[(2S)-4-naphthalen-2-ylsulfonylpiperazin-2-yl]methyl]-N'-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]butane-1,4-diamine
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C28H37N5O2S
 1
1
IC50 = 71 nM
   TI
   LI
   LO
   TS
CP0443356
N'-[(4-phenylpiperazin-2-yl)methyl]-N'-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]butane-1,4-diamine
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C24H35N5
 1
1
IC50 = 130 nM
   TI
   LI
   LO
   TS
CP0387771
N'-[[(3R)-2-propan-2-yl-3,4-dihydro-1H-isoquinolin-3-yl]methyl]-N'-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]butane-1,4-diamine
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C26H38N4
 1
1
IC50 = 140 nM
   TI
   LI
   LO
   TS
CP0387865
1,1-dimethyl-3-[4-[[(3R)-1,2,3,4-tetrahydroisoquinolin-3-yl]methyl-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]amino]butyl]urea
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C26H37N5O
 1
1
IC50 = 180 nM
   TI
   LI
   LO
   TS
CP0125301
N'-[[(2S)-4-benzylpiperazin-2-yl]methyl]-N'-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]butane-1,4-diamine
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C25H37N5
 1
1
IC50 = 190 nM
   TI
   LI
   LO
   TS
CP0450351
N'-[[(2R)-4-benzylpiperazin-2-yl]methyl]-N'-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]butane-1,4-diamine
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C25H37N5
 1
1
IC50 = 230 nM
   TI
   LI
   LO
   TS
CP0428477
N'-[[(2R)-piperazin-2-yl]methyl]-N'-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]butane-1,4-diamine
   Show/Hide
C18H31N5
 1
1
IC50 = 255 nM
   TI
   LI
   LO
   TS
CP0524752
N'-[[(3R)-2-(pyridin-3-ylmethyl)-3,4-dihydro-1H-isoquinolin-3-yl]methyl]-N'-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]butane-1,4-diamine
   Show/Hide
C29H37N5
 1
1
IC50 = 350 nM
   TI
   LI
   LO
   TS
CP0387863
N'-[[(3R)-2-(1,3-oxazol-4-ylmethyl)-3,4-dihydro-1H-isoquinolin-3-yl]methyl]-N'-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]butane-1,4-diamine
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C27H35N5O
 1
1
IC50 = 490 nM
   TI
   LI
   LO
   TS
CP0392740
2-[(3R)-3-[[4-aminobutyl-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]amino]methyl]-3,4-dihydro-1H-isoquinolin-2-yl]-1-morpholin-4-ylethanone
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C29H41N5O2
 1
1
IC50 = 570 nM
   TI
   LI
   LO
   TS
CP0432257
N'-[[(3R)-2-(pyridin-4-ylmethyl)-3,4-dihydro-1H-isoquinolin-3-yl]methyl]-N'-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]butane-1,4-diamine
   Show/Hide
C29H37N5
 1
1
IC50 = 660 nM
   TI
   LI
   LO
   TS
CP0528841
N'-[[(2S)-piperazin-2-yl]methyl]-N'-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]butane-1,4-diamine
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C18H31N5
 1
1
IC50 = 1200 nM
   TI
   LI
   LO
   TS
CP0511994
(6,6-dimethyl-5H-imidazo[2,1-b][1,3]thiazol-3-yl)methyl N'-[4-[[[2-[2-[4-[[2-[2-[[(4R,4aS,7R,7aR,12bS)-3-(cyclopropylmethyl)-4a,9-dihydroxy-1,2,4,5,6,7,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl]amino]-2-oxoethoxy]acetyl]amino]butylamino]-2-oxoethoxy]acetyl]amino]methyl]cyclohexyl]carbamimidothioate
   Show/Hide
C48H69N9O9S2
 1
1
IC50 = 3600 nM
   TI
   LI
   LO
   TS
CP0406573
(3S)-3-[[4-aminobutyl-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]amino]methyl]-N-phenylpiperazine-1-carboxamide
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C25H36N6O
 1
1
IC50 = 21000 nM
   TI
   LI
   LO
   TS
CP0564856
(6,6-dimethyl-5H-imidazo[2,1-b][1,3]thiazol-3-yl)methyl N-cyclohexyl-N'-[4-[[[2-[2-[4-[[2-[2-(methylamino)-2-oxoethoxy]acetyl]amino]butylamino]-2-oxoethoxy]acetyl]amino]methyl]cyclohexyl]carbamimidothioate
   Show/Hide
C35H58N8O6S2
 1
1
IC50 = 69000 nM
   TI
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