BDBM82542 5'-N-ethylcarboxamidoinosine::NECI

SMILES: CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c1nc[nH]c2=O

InChI Key: InChIKey=ZSGAHCIPJXWFOB-FLNNQWSLSA-N

Data: 3 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 3 hits for monomerid = 82542   

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
Transmembrane and immunoglobulin domain-containing 3 (RAT)	BDBM82542 (5'-N-ethylcarboxamidoinosine | NECI) Show SMILES CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c1nc[nH]c2=O |r| Show InChI InChI=1S/C12H15N5O5/c1-2-13-11(21)8-6(18)7(19)12(22-8)17-4-16-5-9(17)14-3-15-10(5)20/h3-4,6-8,12,18-19H,2H2,1H3,(H,13,21)(H,14,15,20)/t6-,7+,8-,12+/m0/s1	KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Diabetes, Digestive and Kidney Diseases Curated by PDSP Ki Database									Mol Pharmacol 45: 1101-11 (1994) BindingDB Entry DOI: 10.7270/Q26Q1VR9
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Rattus norvegicus (rat))	BDBM82542 (5'-N-ethylcarboxamidoinosine | NECI) Show SMILES CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c1nc[nH]c2=O |r| Show InChI InChI=1S/C12H15N5O5/c1-2-13-11(21)8-6(18)7(19)12(22-8)17-4-16-5-9(17)14-3-15-10(5)20/h3-4,6-8,12,18-19H,2H2,1H3,(H,13,21)(H,14,15,20)/t6-,7+,8-,12+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Diabetes, Digestive and Kidney Diseases Curated by PDSP Ki Database									Mol Pharmacol 45: 1101-11 (1994) BindingDB Entry DOI: 10.7270/Q26Q1VR9
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Rattus norvegicus (rat))	BDBM82542 (5'-N-ethylcarboxamidoinosine | NECI) Show SMILES CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c1nc[nH]c2=O |r| Show InChI InChI=1S/C12H15N5O5/c1-2-13-11(21)8-6(18)7(19)12(22-8)17-4-16-5-9(17)14-3-15-10(5)20/h3-4,6-8,12,18-19H,2H2,1H3,(H,13,21)(H,14,15,20)/t6-,7+,8-,12+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Diabetes, Digestive and Kidney Diseases Curated by PDSP Ki Database									Mol Pharmacol 45: 1101-11 (1994) BindingDB Entry DOI: 10.7270/Q26Q1VR9
					More data for this Ligand-Target Pair