BDBM23638 2-{[4,8-bis({4-azatricyclo[4.3.1.1^{3,8}]undecan-4-yl})-6-[(2-hydroxyethyl)amino]pyrimido[5,4-d][1,3]diazin-2-yl]amino}ethan-1-ol::Dipyridamole Analogue, 20

SMILES: OCCNc1nc(N2CC3CC4CC(C3)CC2C4)c2nc(NCCO)nc(N3CC4CC5CC(C4)CC3C5)c2n1

InChI Key: InChIKey=OVGSNNACDGAGFD-UHFFFAOYSA-N

Data: 1 Other

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 = 23638   

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
Equilibrative Nucleoside Transporter 1 (ENT1) (Homo sapiens (Human))	BDBM23638 (2-{[4,8-bis({4-azatricyclo[4.3.1.1^{3,8}]undecan-4...) Show SMILES OCCNc1nc(N2CC3CC4CC(C3)CC2C4)c2nc(NCCO)nc(N3CC4CC5CC(C4)CC3C5)c2n1 |TLB:8:9:17.16.15:12,14:13:17:10.9.8.7,14:9:17:15.12.13,28:29:37.36.35:32,34:33:37:30.29.28.27,34:29:37:35.32.33,THB:26:27:37:35.32.33,6:7:17:15.12.13,7:16:12:10.9.14,27:36:32:30.29.34| Show InChI InChI=1S/C30H44N8O2/c39-3-1-31-29-33-25-26(27(35-29)37-15-21-7-17-5-18(8-21)12-23(37)11-17)34-30(32-2-4-40)36-28(25)38-16-22-9-19-6-20(10-22)14-24(38)13-19/h17-24,39-40H,1-16H2,(H,31,33,35)(H,32,34,36)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	n/a	n/a	n/a	7.4	22
University of Tennessee Health Science Center					Assay Description The compounds were tested to determine their ENT1 nucleoside transporter binding ability by a flow cytometric assay using human leukemia K562 cells i...				J Med Chem 50: 3906-20 (2007) Article DOI: 10.1021/jm070311l BindingDB Entry DOI: 10.7270/Q2XK8CVN
					More data for this Ligand-Target Pair