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SMILES: CC(C)CN(CC(C)C)c1ccc(cc1NC(=O)Nc1ccc(cc1)C1CC1)[C@@H]1C[C@@H]1C(O)=O

InChI Key: InChIKey=NBEQZUODWKQMBB-ZEQRLZLVSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 168334   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Indoleamine 2,3-dioxygenase 1


(Homo sapiens (Human))		BDBM168334
PNG
(US9675571, 20)
Show SMILES CC(C)CN(CC(C)C)c1ccc(cc1NC(=O)Nc1ccc(cc1)C1CC1)[C@@H]1C[C@@H]1C(O)=O |r|
Show InChI InChI=1S/C28H37N3O3/c1-17(2)15-31(16-18(3)4)26-12-9-21(23-14-24(23)27(32)33)13-25(26)30-28(34)29-22-10-7-20(8-11-22)19-5-6-19/h7-13,17-19,23-24H,5-6,14-16H2,1-4H3,(H,32,33)(H2,29,30,34)/t23-,24-/m0/s1
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US Patent
n/an/an/an/a 61n/an/an/a25



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US Patent


Assay Description
Human IDO1/HEK293 cells were seeded at 10,000 cells per 50 uL per well with RPMI/phenol red free media contains 10% FBS in a 384-well black wall clea...

US Patent US9675571 (2017)


BindingDB Entry DOI: 10.7270/Q2BK19HD
More data for this
Ligand-Target Pair