BDBM50367693 CHEMBL604607

SMILES: Cc1cccc(c1)C(CNc1ncnc2n(cnc12)C1O[C@H](CO)[C@@H](O)[C@H]1O)c1cccc(C)c1

InChI Key: InChIKey=KIAVBAPYCGUDDF-CUVLRLMBSA-N

Data: 2 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 2 hits for monomerid = 50367693   

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
Adenosine receptor A1 (Rattus norvegicus (rat))	BDBM50367693 (CHEMBL604607) Show SMILES Cc1cccc(c1)C(CNc1ncnc2n(cnc12)C1O[C@H](CO)[C@@H](O)[C@H]1O)c1cccc(C)c1 |r| Show InChI InChI=1S/C26H29N5O4/c1-15-5-3-7-17(9-15)19(18-8-4-6-16(2)10-18)11-27-24-21-25(29-13-28-24)31(14-30-21)26-23(34)22(33)20(12-32)35-26/h3-10,13-14,19-20,22-23,26,32-34H,11-12H2,1-2H3,(H,27,28,29)/t20-,22-,23-,26?/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	9.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Binding affinity at adenosine A1 receptor from rat brain membranes by [3H]N6-cyclohexyladenosine displacement.				J Med Chem 31: 1282-5 (1988) BindingDB Entry DOI: 10.7270/Q2KK9CCN
					More data for this Ligand-Target Pair
Adenosine A2 receptor (Rattus norvegicus-Rattus norvegicus (rat))	BDBM50367693 (CHEMBL604607) Show SMILES Cc1cccc(c1)C(CNc1ncnc2n(cnc12)C1O[C@H](CO)[C@@H](O)[C@H]1O)c1cccc(C)c1 |r| Show InChI InChI=1S/C26H29N5O4/c1-15-5-3-7-17(9-15)19(18-8-4-6-16(2)10-18)11-27-24-21-25(29-13-28-24)31(14-30-21)26-23(34)22(33)20(12-32)35-26/h3-10,13-14,19-20,22-23,26,32-34H,11-12H2,1-2H3,(H,27,28,29)/t20-,22-,23-,26?/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	19	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Binding affinity at adenosine A2 receptor from rat striatal membranes by [3H]NECA displacement.				J Med Chem 31: 1282-5 (1988) BindingDB Entry DOI: 10.7270/Q2KK9CCN
					More data for this Ligand-Target Pair