General Information of the Protein
Protein ID
PT06416
Protein Name
Carbamoyl-phosphate synthase [ammonia], mitochondrial
Secondarily
Protein Name
Carbamoyl-phosphate synthetase I
Gene Name
CPS1
Sequence
MTRILTAFKVVRTLKTGFGFTNVTAHQKWKFSRPGIRLLSVKAQTAHIVLEDGTKMKGYSFGHPSSVAGEVVFNTGLGGYPEAITDPAYKGQILTMANPIIGNGGAPDTTALDELGLSKYLESNGIKVSGLLVLDYSKDYNHWLATKSLGQWLQEEKVPAIYGVDTRMLTKIIRDKGTMLGKIEFEGQPVDFVDPNKQNLIAEVSTKDVKVYGKGNPTKVVAVDCGIKNNVIRLLVKRGAEVHLVPWNHDFTKMEYDGILIAGGPGNPALAEPLIQNVRKILESDRKEPLFGISTGNLITGLAAGAKTYKMSMANRGQNQPVLNITNKQAFITAQNHGYALDNTLPAGWKPLFVNVNDQTNEGIMHESKPFFAVQFHPEVTPGPIDTEYLFDSFFSLIKKGKATTITSVLPKPALVASRVEVSKVLILGSGGLSIGQAGEFDYSGSQAVKAMKEENVKTVLMNPNIASVQTNEVGLKQADTVYFLPITPQFVTEVIKAEQPDGLILGMGGQTALNCGVELFKRGVLKEYGVKVLGTSVESIMATEDRQLFSDKLNEINEKIAPSFAVESIEDALKAADTIGYPVMIRSAYALGGLGSGICPNRETLMDLSTKAFAMTNQILVEKSVTGWKEIEYEVVRDADDNCVTVCNMENVDAMGVHTGDSVVVAPAQTLSNAEFQMLRRTSINVVRHLGIVGECNIQFALHPTSMEYCIIEVNARLSRSSALASKATGYPLAFIAAKIALGIPLPEIKNVVSGKTSACFEPSLDYMVTKIPRWDLDRFHGTSSRIGSSMKSVGEVMAIGRTFEESFQKALRMCHPSIEGFTPRLPMNKEWPSNLDLRKELSEPSSTRIYAIAKAIDDNMSLDEIEKLTYIDKWFLYKMRDILNMEKTLKGLNSESMTEETLKRAKEIGFSDKQISKCLGLTEAQTRELRLKKNIHPWVKQIDTLAAEYPSVTNYLYVTYNGQEHDVNFDDHGMMVLGCGPYHIGSSVEFDWCAVSSIRTLRQLGKKTVVVNCNPETVSTDFDECDKLYFEELSLERILDIYHQEACGGCIISVGGQIPNNLAVPLYKNGVKIMGTSPLQIDRAEDRSIFSAVLDELKVAQAPWKAVNTLNEALEFAKSVDYPCLLRPSYVLSGSAMNVVFSEDEMKKFLEEATRVSQEHPVVLTKFVEGAREVEMDAVGKDGRVISHAISEHVEDAGVHSGDATLMLPTQTISQGAIEKVKDATRKIAKAFAISGPFNVQFLVKGNDVLVIECNLRASRSFPFVSKTLGVDFIDVATKVMIGENVDEKHLPTLDHPIIPADYVAIKAPMFSWPRLRDADPILRCEMASTGEVACFGEGIHTAFLKAMLSTGFKIPQKGILIGIQQSFRPRFLGVAEQLHNEGFKLFATEATSDWLNANNVPATPVAWPSQEGQNPSLSSIRKLIRDGSIDLVINLPNNNTKFVHDNYVIRRTAVDSGIPLLTNFQVTKLFAEAVQKSRKVDSKSLFHYRQYSAGKAA
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Organism
Homo sapiens, Human
Protein Classification
Enzyme
>
Ligase
Function
Involved in the urea cycle of ureotelic animals where the enzyme plays an important role in removing excess ammonia from the cell.
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Uniprot ID
Primary ID:
P31327

Secondarily ID:
B7Z818
J3KQL0
O43774
Q53TL5
Q59HF8
Q7Z5I5
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Ensembl ID
ENSG00000021826
HGNC ID
HGNC:2323
Subcellular Location
Mitochondrion
Nucleus
Nucleolus
Cell membrane
Map of Molecular Bioactivity Related to the Protein
Map of Molecular Bioactivity Related to the Protein

Protein
Cell Line
Compound

Bioactivity Value:

<= 0.1 μM
> 0.1 μM and <= 10 μM
> 10 μM
Imprecise Activity
Table of Molecular Bioactivities Related to the Protein
Cell Line ID: CL000012 , Sf21
 Cell Line Info 
Compound ID Compound Name Compound Formula
CP0901625
 Compound Info 
((2R,6R)-4-(1H-indole-6-carbonyl)-2,6-dimethylpiperazin-1-yl)(2-fluoro-4-methoxyphenyl)methanone
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C23H24FN3O3
  1
1
IC50 = 66 nM
 Bioactivity Info 
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CP0409631
 Compound Info 
(4-ethoxy-2-fluorophenyl)-[(3R,5R)-4-(2-fluoro-4-methoxybenzoyl)-3,5-dimethylpiperazin-1-yl]methanone
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C23H26F2N2O4
  1
1
IC50 = 130 nM
 Bioactivity Info 
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CP0931230
 Compound Info 
((2R,6R)-2,6-dimethyl-4-(2-methyl-1H-indole-6-carbonyl)piperazin-1-yl)(2-fluoro-4-methoxyphenyl)methanone
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C24H26FN3O3
  1
1
IC50 = 170 nM
 Bioactivity Info 
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CP0460805
 Compound Info 
(2-fluoro-4-methoxyphenyl)-[(3R,5R)-4-(2-fluoro-4-methylbenzoyl)-3,5-dimethylpiperazin-1-yl]methanone
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C22H24F2N2O3
  1
1
IC50 = 360 nM
 Bioactivity Info 
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CP0549384
 Compound Info 
[(3R,5R)-4-(2-fluoro-4-methoxybenzoyl)-3,5-dimethylpiperazin-1-yl]-(2-fluoro-4-methoxyphenyl)methanone
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C22H24F2N2O4
  1
1
IC50 = 360 nM
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CP0388243
 Compound Info 
[(3R,5R)-4-(4-ethoxy-2-fluorobenzoyl)-3,5-dimethylpiperazin-1-yl]-(2-fluoro-4-methoxyphenyl)methanone
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C23H26F2N2O4
  1
1
IC50 = 380 nM
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CP0549385
 Compound Info 
[(3R,5R)-4-(2-fluoro-4-methoxybenzoyl)-3,5-dimethylpiperazin-1-yl]-(3-fluoro-4-methoxyphenyl)methanone
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C22H24F2N2O4
  1
1
IC50 = 540 nM
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CP0571419
 Compound Info 
[(3R,5R)-4-(2,4-difluorobenzoyl)-3,5-dimethylpiperazin-1-yl]-(2-fluoro-4-methoxyphenyl)methanone
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C21H21F3N2O3
  1
1
IC50 = 1300 nM
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CP0547416
 Compound Info 
(2-fluoro-4-methoxyphenyl)-[(3R,5R)-4-(2-fluoro-4-propan-2-yloxybenzoyl)-3,5-dimethylpiperazin-1-yl]methanone
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C24H28F2N2O4
  1
1
IC50 = 1400 nM
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CP0388278
 Compound Info 
1-N-benzyl-1-N-methyl-4-N-(4-methyl-1,3-thiazol-2-yl)piperidine-1,4-dicarboxamide
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C19H24N4O2S
  1
1
IC50 = 1500 nM
 Bioactivity Info 
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CP0552914
 Compound Info 
[(3R,5R)-4-(2-fluoro-4-methoxybenzoyl)-3,5-dimethylpiperazin-1-yl]-(2-fluoro-4-methylphenyl)methanone
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C22H24F2N2O3
  1
1
IC50 = 2200 nM
 Bioactivity Info 
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CP0492494
 Compound Info 
(2,4-difluorophenyl)-[(3R,5R)-4-(2-fluoro-4-methoxybenzoyl)-3,5-dimethylpiperazin-1-yl]methanone
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C21H21F3N2O3
  1
1
IC50 = 2600 nM
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CP0944469
 Compound Info 
3H-benzimidazol-5-yl-[(3R,5R)-4-(2-fluoro-4-methoxy-benzoyl)-3,5-dimethyl-piperazin-1-yl]methanone
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C22H23FN4O3
  1
1
IC50 = 4900 nM
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CP0559843
 Compound Info 
[(3R,5R)-4-(2-fluoro-5-methoxybenzoyl)-3,5-dimethylpiperazin-1-yl]-(2-fluoro-4-methoxyphenyl)methanone
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C22H24F2N2O4
  1
1
IC50 = 5100 nM
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CP0516539
 Compound Info 
[4-(2-fluoro-4-methoxybenzoyl)-3-methylpiperazin-1-yl]-(2-fluoro-4-methoxyphenyl)methanone
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C21H22F2N2O4
  1
1
IC50 = 5200 nM
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CP0516540
 Compound Info 
[4-(2-fluoro-4-methoxybenzoyl)-3,5-dimethylpiperazin-1-yl]-(2-fluoro-4-methoxyphenyl)methanone
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C22H24F2N2O4
  1
1
IC50 = 6300 nM
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CP0539951
 Compound Info 
2,3-dihydro-1H-indol-6-yl-[(3R,5R)-4-(2-fluoro-4-methoxybenzoyl)-3,5-dimethylpiperazin-1-yl]methanone
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C23H26FN3O3
  1
1
IC50 = 6400 nM
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CP0552913
 Compound Info 
[(3S,5S)-4-(2-fluoro-4-methoxybenzoyl)-3,5-dimethylpiperazin-1-yl]-(2-fluoro-4-methoxyphenyl)methanone
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C22H24F2N2O4
  1
1
IC50 = 6500 nM
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CP0559922
 Compound Info 
[(3R,5S)-4-(2-fluoro-4-methoxybenzoyl)-3,5-dimethylpiperazin-1-yl]-(2-fluoro-4-methoxyphenyl)methanone
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C22H24F2N2O4
  1
1
IC50 = 6900 nM
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CP0559844
 Compound Info 
[(3R,5R)-4-(2-fluoro-4-methoxybenzoyl)-3,5-dimethylpiperazin-1-yl]-(1-methyl-2,3-dihydroindol-6-yl)methanone
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C24H28FN3O3
  1
1
IC50 = 7700 nM
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CP0422682
 Compound Info 
[4-(2-fluoro-4-methoxybenzoyl)piperazin-1-yl]-(2-fluoro-4-methoxyphenyl)methanone
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C20H20F2N2O4
  1
1
IC50 = 7800 nM
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CP0552912
 Compound Info 
[4-(2-fluoro-4-methoxybenzoyl)-2,5-dimethylpiperazin-1-yl]-(2-fluoro-4-methoxyphenyl)methanone
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C22H24F2N2O4
  1
1
IC50 = 11400 nM
 Bioactivity Info 
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CP0422683
 Compound Info 
[4-(2-fluoro-4-methoxybenzoyl)-1,4-diazepan-1-yl]-(2-fluoro-4-methoxyphenyl)methanone
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C21H22F2N2O4
  1
1
IC50 = 18900 nM
 Bioactivity Info 
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CP0492493
 Compound Info 
[1-(2-fluoro-4-methoxybenzoyl)piperidin-4-yl]-(2-fluoro-4-methoxyphenyl)methanone
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C21H21F2NO4
  1
1
IC50 = 21500 nM
 Bioactivity Info 
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CP0416376
 Compound Info 
[(3R,5R)-4-(2-fluoro-4-methoxybenzoyl)-3,5-dimethylpiperazin-1-yl]-(1-methylindol-6-yl)methanone
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C24H26FN3O3
  1
1
IC50 = 31000 nM
 Bioactivity Info 
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CP0516541
 Compound Info 
[4-(2-fluoro-4-methoxybenzoyl)-2,3-dimethylpiperazin-1-yl]-(2-fluoro-4-methoxyphenyl)methanone
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C22H24F2N2O4
  1
1
IC50 = 36000 nM
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CP0388241
 Compound Info 
[(3R,5R)-4-(2-fluoro-4-methoxybenzoyl)-3,5-dimethylpiperazin-1-yl]-(2-fluoro-3-methoxyphenyl)methanone
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C22H24F2N2O4
  1
1
IC50 > 66000 nM
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CP0521341
 Compound Info 
N-[4-fluoro-3-[(3R,5R)-4-(2-fluoro-4-methoxybenzoyl)-3,5-dimethylpiperazine-1-carbonyl]phenyl]acetamide
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C23H25F2N3O4
  1
1
IC50 > 66000 nM
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CP0532271
 Compound Info 
[(2R,6R)-4-(2-fluoro-5-methoxybenzoyl)-2,6-dimethylpiperazin-1-yl]-(2-fluoro-4-methoxyphenyl)methanone
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C22H24F2N2O4
  1
1
IC50 > 66000 nM
 Bioactivity Info 
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CP0566150
 Compound Info 
[5-(2-fluoro-4-methoxybenzoyl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-(2-fluoro-4-methoxyphenyl)methanone
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C21H20F2N2O4
  1
1
IC50 > 66000 nM
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CP0903587
 Compound Info 
((2R,6R)-4-(1H-indole-5-carbonyl)-2,6-dimethylpiperazin-1-yl)(2-fluoro-4-methoxyphenyl)methanone
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C23H24FN3O3
  1
1
IC50 > 66000 nM
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Clinical Information about the Protein
Target 1 ( Carbamoyl-phosphate synthetase I (CPS1) )
Target Type Successful Target
Disease 1 Target-related Disease  1
1 Acute hyperammonaemia [ICD-11: 5C50.A]
Approved Drug(s) 1 Approved Drug  1
1 Carglumic acid
 Drug Info 
Approved
Acute hyperammonaemia