BDBM50011566 3-(4-Amino-pyrrolo[2,3-d]pyrimidin-7-yl)-nonan-2-ol::CHEMBL18659

SMILES: CCCCCCC(C(C)O)n1ccc2c(N)ncnc12

InChI Key: InChIKey=XJXHFKSYERWTQJ-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50011566   

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 deaminase (Homo sapiens (Human))	BDBM50011566 (3-(4-Amino-pyrrolo[2,3-d]pyrimidin-7-yl)-nonan-2-o...) Show SMILES CCCCCCC(C(C)O)n1ccc2c(N)ncnc12 Show InChI InChI=1S/C15H24N4O/c1-3-4-5-6-7-13(11(2)20)19-9-8-12-14(16)17-10-18-15(12)19/h8-11,13,20H,3-7H2,1-2H3,(H2,16,17,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.80E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Camerino Curated by ChEMBL					Assay Description Inhibition constant (Ki) against Human erythrocyte adenosine deaminase				J Med Chem 31: 390-3 (1988) BindingDB Entry DOI: 10.7270/Q2X067M7
					More data for this Ligand-Target Pair
Adenosine deaminase (Bos taurus (bovine))	BDBM50011566 (3-(4-Amino-pyrrolo[2,3-d]pyrimidin-7-yl)-nonan-2-o...) Show SMILES CCCCCCC(C(C)O)n1ccc2c(N)ncnc12 Show InChI InChI=1S/C15H24N4O/c1-3-4-5-6-7-13(11(2)20)19-9-8-12-14(16)17-10-18-15(12)19/h8-11,13,20H,3-7H2,1-2H3,(H2,16,17,18)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Camerino Curated by ChEMBL					Assay Description Inhibition constant (Ki) against calf intestine adenosine deaminase				J Med Chem 31: 390-3 (1988) BindingDB Entry DOI: 10.7270/Q2X067M7
					More data for this Ligand-Target Pair
Adenosine deaminase (Bos taurus (bovine))	BDBM50011566 (3-(4-Amino-pyrrolo[2,3-d]pyrimidin-7-yl)-nonan-2-o...) Show SMILES CCCCCCC(C(C)O)n1ccc2c(N)ncnc12 Show InChI InChI=1S/C15H24N4O/c1-3-4-5-6-7-13(11(2)20)19-9-8-12-14(16)17-10-18-15(12)19/h8-11,13,20H,3-7H2,1-2H3,(H2,16,17,18)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Camerino Curated by ChEMBL					Assay Description Inhibition of calf intestinal adenosine deaminase				J Med Chem 34: 1187-92 (1991) BindingDB Entry DOI: 10.7270/Q20V8DDM
					More data for this Ligand-Target Pair
Adenosine deaminase (Bos taurus (bovine))	BDBM50011566 (3-(4-Amino-pyrrolo[2,3-d]pyrimidin-7-yl)-nonan-2-o...) Show SMILES CCCCCCC(C(C)O)n1ccc2c(N)ncnc12 Show InChI InChI=1S/C15H24N4O/c1-3-4-5-6-7-13(11(2)20)19-9-8-12-14(16)17-10-18-15(12)19/h8-11,13,20H,3-7H2,1-2H3,(H2,16,17,18)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Camerino Curated by ChEMBL					Assay Description In vitro innhibition of adenosine deaminase isolated from calf intestine.				J Med Chem 37: 201-5 (1994) BindingDB Entry DOI: 10.7270/Q2KD1ZHQ
					More data for this Ligand-Target Pair