BDBM50453494 CHEMBL4210195

SMILES: CN1C[C@H](Cc2ccc(Cl)cc2)N(C[C@@H]1CO)C1CCN(CC1)c1n[nH]c(N)n1

InChI Key: InChIKey=FYPXUGNWIURDGX-ZWKOTPCHSA-N

Data: 2 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 2 hits for monomerid = 50453494   

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
Acidic mammalian chitinase (Mus musculus)	BDBM50453494 (CHEMBL4210195) Show SMILES CN1C[C@H](Cc2ccc(Cl)cc2)N(C[C@@H]1CO)C1CCN(CC1)c1n[nH]c(N)n1 |r| Show InChI InChI=1S/C20H30ClN7O/c1-26-11-17(10-14-2-4-15(21)5-3-14)28(12-18(26)13-29)16-6-8-27(9-7-16)20-23-19(22)24-25-20/h2-5,16-18,29H,6-13H2,1H3,(H3,22,23,24,25)/t17-,18+/m0/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article	n/a	n/a	1.25E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of mouse AMCase using 4-methylumbelliferyl beta-D-N,N' diacetylchitobioside hydrate as substrate measured after 60 mins by fluorometric me...				Citation and Details Article DOI: 10.1016/j.bmcl.2017.12.047 BindingDB Entry DOI: 10.7270/Q2ZK5K77
					More data for this Ligand-Target Pair
Chitotriosidase-1 (Mus musculus)	BDBM50453494 (CHEMBL4210195) Show SMILES CN1C[C@H](Cc2ccc(Cl)cc2)N(C[C@@H]1CO)C1CCN(CC1)c1n[nH]c(N)n1 |r| Show InChI InChI=1S/C20H30ClN7O/c1-26-11-17(10-14-2-4-15(21)5-3-14)28(12-18(26)13-29)16-6-8-27(9-7-16)20-23-19(22)24-25-20/h2-5,16-18,29H,6-13H2,1H3,(H3,22,23,24,25)/t17-,18+/m0/s1	UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article	n/a	n/a	175	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of mouse CHIT1 using 4-methylumbelliferyl beta-D-N,N',N'' triacetylchitotrioside as substrate measured after 60 mins by fluorometric metho...				Citation and Details Article DOI: 10.1016/j.bmcl.2017.12.047 BindingDB Entry DOI: 10.7270/Q2ZK5K77
					More data for this Ligand-Target Pair