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Target
Indoleamine 2,3-dioxygenase 1
Ligand
BDBM370513
Substrate
n/a
Meas. Tech.
Enzymatic IDO Assay
IC50
550±n/a nM
Citation
 Mautino, M; Kumar, S; Waldo, J; Jaipuri, F; Kesharwani, T; Zhang, X IDO inhibitors US Patent  US10233190 Publication Date 3/19/2019
Target
Name:
Indoleamine 2,3-dioxygenase 1
Synonyms:
I23O1_HUMAN | IDO | IDO-1 | IDO1 | INDO | Indoleamine 2,3-Dioxygenasae (IDO) | Indoleamine 2,3-dioxygenase | Indoleamine-pyrrole 2,3-dioxygenase
Type:
Enzyme
Mol. Mass.:
45330.80
Organism:
Homo sapiens (Human)
Description:
P14902
Residue:
403
Sequence:
MAHAMENSWTISKEYHIDEEVGFALPNPQENLPDFYNDWMFIAKHLPDLIESGQLRERVEKLNMLSIDHLTDHKSQRLARLVLGCITMAYVWGKGHGDVRKVLPRNIAVPYCQLSKKLELPPILVYADCVLANWKKKDPNKPLTYENMDVLFSFRDGDCSKGFFLVSLLVEIAAASAIKVIPTVFKAMQMQERDTLLKALLEIASCLEKALQVFHQIHDHVNPKAFFSVLRIYLSGWKGNPQLSDGLVYEGFWEDPKEFAGGSAGQSSVFQCFDVLLGIQQTAGGGHAAQFLQDMRRYMPPAHRNFLCSLESNPSVREFVLSKGDAGLREAYDACVKALVSLRSYHLQIVTKYILIPASQQPKENKTSEDPSKLEAKGTGGTDLMNFLKTVRSTTEKSLLKEG
  
Inhibitor
Name:
BDBM370513
Synonyms:
4-(1-hydroxy-2-(5H-imidazo[5,1-a]isoindol-5- yl)ethyl)-N-(2-(methylsulfonamido)ethyl) cyclohexanecarboxamide | US10233190, Example 1432
Type:
Small organic molecule
Emp. Form.:
C22H30N4O4S
Mol. Mass.:
446.563
SMILES:
CS(=O)(=O)NCCNC(=O)C1CCC(CC1)C(O)CC1c2ccccc2-c2cncn12 |(7.95,-4.88,;6.86,-3.79,;7.95,-2.71,;5.77,-4.88,;5.77,-2.71,;6.17,-1.22,;5.08,-.13,;5.48,1.36,;4.39,2.45,;4.79,3.93,;2.9,2.05,;2.5,.56,;1.02,.16,;-.07,1.25,;.33,2.74,;1.81,3.14,;-1.56,.85,;-1.96,-.63,;-2.65,1.94,;-4.14,1.54,;-5.28,2.57,;-5.28,4.11,;-6.61,4.88,;-7.95,4.11,;-7.95,2.57,;-6.61,1.8,;-6.29,.3,;-6.92,-1.11,;-5.78,-2.14,;-4.44,-1.37,;-4.76,.14,)|
Structure:
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