BDBM50247143 CHEMBL513210::TX-2234::[4-(1,4-Dioxido-1,2,4-benzotriazin-3-yl)aminobutyl]-(2S)-N-tert-butoxycarbonyl-2-amino-(1-methyl-indole-3-yl)propanamide

SMILES: Cn1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)NCCCCNc2n[n+]([O-])c3ccccc3[n+]2[O-])c2ccccc12

InChI Key: InChIKey=DILPBLBMQMBWKT-NRFANRHFSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50247143   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Indoleamine 2,3-dioxygenase (Homo sapiens (Human))	BDBM50247143 (CHEMBL513210 | TX-2234 | [4-(1,4-Dioxido-1,2,4-ben...) Show SMILES Cn1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)NCCCCNc2n[n+]([O-])c3ccccc3[n+]2[O-])c2ccccc12 |r| Show InChI InChI=1S/C28H35N7O5/c1-28(2,3)40-27(37)31-21(17-19-18-33(4)22-12-6-5-11-20(19)22)25(36)29-15-9-10-16-30-26-32-35(39)24-14-8-7-13-23(24)34(26)38/h5-8,11-14,18,21H,9-10,15-17H2,1-4H3,(H,29,36)(H,30,32)(H,31,37)/t21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.67E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokushima Curated by ChEMBL					Assay Description Inhibition of indoleamine 2,3-dioxygenase (unknown origin) in aerobic condition				Bioorg Med Chem 16: 8661-9 (2008) Article DOI: 10.1016/j.bmc.2008.07.087 BindingDB Entry DOI: 10.7270/Q2W66KKP
					More data for this Ligand-Target Pair