BDBM50243693 CHEMBL4091907

SMILES: CN(CCc1ccc(cc1)C1CC1)C1CCN(CC1)c1nc(N)n[nH]1

InChI Key: InChIKey=AGFTURTXLJUQAU-UHFFFAOYSA-N

Data: 4 IC50

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 = 50243693   

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
Chitinase 1 (Homo sapiens (Human))	BDBM50243693 (CHEMBL4091907) Show SMILES CN(CCc1ccc(cc1)C1CC1)C1CCN(CC1)c1nc(N)n[nH]1 Show InChI InChI=1S/C19H28N6/c1-24(11-8-14-2-4-15(5-3-14)16-6-7-16)17-9-12-25(13-10-17)19-21-18(20)22-23-19/h2-5,16-17H,6-13H2,1H3,(H3,20,21,22,23)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	765	n/a	n/a	n/a	n/a	n/a	n/a
OncoArendi Therapeutics SA Curated by ChEMBL					Assay Description Inhibition of human recombinant full length C-terminal His-tagged chitotriosidase expressed in CHO-K1 cells using 4-methylumbelliferyl-beta-D-N,N',N\...				J Med Chem 61: 695-710 (2018) Article DOI: 10.1021/acs.jmedchem.7b01051 BindingDB Entry DOI: 10.7270/Q2J105J5
					More data for this Ligand-Target Pair
Chitotriosidase-1 (Mus musculus)	BDBM50243693 (CHEMBL4091907) Show SMILES CN(CCc1ccc(cc1)C1CC1)C1CCN(CC1)c1nc(N)n[nH]1 Show InChI InChI=1S/C19H28N6/c1-24(11-8-14-2-4-15(5-3-14)16-6-7-16)17-9-12-25(13-10-17)19-21-18(20)22-23-19/h2-5,16-17H,6-13H2,1H3,(H3,20,21,22,23)	UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.07E+3	n/a	n/a	n/a	n/a	n/a	n/a
OncoArendi Therapeutics SA Curated by ChEMBL					Assay Description Inhibition of mouse recombinant full length C-terminal His-tagged chitotriosidase expressed in CHO-K1 cells using 4-methylumbelliferyl-beta-D-N,N',N\...				J Med Chem 61: 695-710 (2018) Article DOI: 10.1021/acs.jmedchem.7b01051 BindingDB Entry DOI: 10.7270/Q2J105J5
					More data for this Ligand-Target Pair
Acidic mammalian chitinase (AMCase) (Homo sapiens (Human))	BDBM50243693 (CHEMBL4091907) Show SMILES CN(CCc1ccc(cc1)C1CC1)C1CCN(CC1)c1nc(N)n[nH]1 Show InChI InChI=1S/C19H28N6/c1-24(11-8-14-2-4-15(5-3-14)16-6-7-16)17-9-12-25(13-10-17)19-21-18(20)22-23-19/h2-5,16-17H,6-13H2,1H3,(H3,20,21,22,23)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.55E+3	n/a	n/a	n/a	n/a	n/a	n/a
OncoArendi Therapeutics SA Curated by ChEMBL					Assay Description Inhibition of human recombinant full length C-terminal His-tagged acidic mammalian chitinase expressed in CHO-K1 cells using 4-methylumbelliferyl-bet...				J Med Chem 61: 695-710 (2018) Article DOI: 10.1021/acs.jmedchem.7b01051 BindingDB Entry DOI: 10.7270/Q2J105J5
					More data for this Ligand-Target Pair
Acidic mammalian chitinase (Mus musculus)	BDBM50243693 (CHEMBL4091907) Show SMILES CN(CCc1ccc(cc1)C1CC1)C1CCN(CC1)c1nc(N)n[nH]1 Show InChI InChI=1S/C19H28N6/c1-24(11-8-14-2-4-15(5-3-14)16-6-7-16)17-9-12-25(13-10-17)19-21-18(20)22-23-19/h2-5,16-17H,6-13H2,1H3,(H3,20,21,22,23)	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.74E+3	n/a	n/a	n/a	n/a	n/a	n/a
OncoArendi Therapeutics SA Curated by ChEMBL					Assay Description Inhibition of mouse recombinant full length C-terminal His-tagged acidic mammalian chitinase expressed in CHO-K1 cells using 4-methylumbelliferyl-bet...				J Med Chem 61: 695-710 (2018) Article DOI: 10.1021/acs.jmedchem.7b01051 BindingDB Entry DOI: 10.7270/Q2J105J5
					More data for this Ligand-Target Pair