Compounds in cluster

158 molecules are shown

Wt: 306.1 BDBM50381325 Purchase	Wt: 362.7 BDBM50366033 Purchase	Wt: 145.1 BDBM50366034 Purchase	Wt: 138.1 BDBM50366037 Purchase	Wt: 127.1 BDBM50366038 Purchase
Wt: 252.2 BDBM50378564 Purchase	Wt: 18.9 BDBM26978 Purchase	Wt: 121.1 BDBM36181 Purchase

<< First | Previous | Displayed 151 to 158 (of 158 total )

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 209 hits for monomerid = 50381325,50366033,50366034,50366037,50366038,50378564,26978,36181
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Cholinesterase (Equus caballus (Horse))	BDBM50378564 (CHEMBL145781) Show SMILES O=c1ccc2ccc(OCc3ccccc3)cc2o1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of the Western Cape Curated by ChEMBL					Assay Description Binding affinity against cathepsin L				Eur J Med Chem 125: 853-864 (2017) Article DOI: 10.1016/j.ejmech.2016.09.041 BindingDB Entry DOI: 10.7270/Q2BP057T
University of the Western Cape Curated by ChEMBL					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50378564 (CHEMBL145781) Show SMILES O=c1ccc2ccc(OCc3ccccc3)cc2o1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.80	n/a	n/a	n/a	n/a	n/a	n/a
University of the Western Cape Curated by ChEMBL					Assay Description Inhibition of [3H]DPDPE binding to recombinant human Opioid receptor delta 1				Eur J Med Chem 125: 853-864 (2017) Article DOI: 10.1016/j.ejmech.2016.09.041 BindingDB Entry DOI: 10.7270/Q2BP057T
University of the Western Cape Curated by ChEMBL					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50378564 (CHEMBL145781) Show SMILES O=c1ccc2ccc(OCc3ccccc3)cc2o1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.49E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of the Western Cape Curated by ChEMBL					Assay Description Inhibition of recombinant human MAO-A assessed as reduction in 4-hydroxyquinolone production using kynuramine as substrate after 20 mins by fluoresce...				Eur J Med Chem 125: 853-864 (2017) Article DOI: 10.1016/j.ejmech.2016.09.041 BindingDB Entry DOI: 10.7270/Q2BP057T
University of the Western Cape Curated by ChEMBL					More data for this Ligand-Target Pair
Lysyl oxidase homolog 3 (Homo sapiens (Human))	BDBM50366038 (CHEMBL1356238) Show SMILES [O-][n+]1ccccc1S Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Hungarian Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of recombinant human LOXL3 expressed in CHO cells using diaminopentane as substrate preincubated for 30 mins followed by substrate additio...				Bioorg Med Chem Lett 28: 3113-3118 (2018) Article DOI: 10.1016/j.bmcl.2018.07.001 BindingDB Entry DOI: 10.7270/Q28P6366
Hungarian Academy of Sciences Curated by ChEMBL					More data for this Ligand-Target Pair
Lysyl oxidase homolog 4 (Homo sapiens)	BDBM50366038 (CHEMBL1356238) Show SMILES [O-][n+]1ccccc1S Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Hungarian Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of recombinant human LOXL4 expressed in baculovirus infected insect cells using diaminopentane as substrate preincubated for 30 mins follo...				Bioorg Med Chem Lett 28: 3113-3118 (2018) Article DOI: 10.1016/j.bmcl.2018.07.001 BindingDB Entry DOI: 10.7270/Q28P6366
Hungarian Academy of Sciences Curated by ChEMBL					More data for this Ligand-Target Pair
Protein-lysine 6-oxidase (Homo sapiens (Human))	BDBM50366038 (CHEMBL1356238) Show SMILES [O-][n+]1ccccc1S Show InChI	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	3.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
Hungarian Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of recombinant human LOX expressed in HEK293 cells using diaminopentane as substrate preincubated for 30 mins followed by substrate additi...				Bioorg Med Chem Lett 28: 3113-3118 (2018) Article DOI: 10.1016/j.bmcl.2018.07.001 BindingDB Entry DOI: 10.7270/Q28P6366
Hungarian Academy of Sciences Curated by ChEMBL					More data for this Ligand-Target Pair
Lysyl oxidase homolog 2 (Homo sapiens (Human))	BDBM50366038 (CHEMBL1356238) Show SMILES [O-][n+]1ccccc1S Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	1.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Hungarian Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of recombinant LOXL2 (unknown origin) expressed in NS0 cells using diaminopentane as substrate preincubated for 30 mins followed by substr...				Bioorg Med Chem Lett 28: 3113-3118 (2018) Article DOI: 10.1016/j.bmcl.2018.07.001 BindingDB Entry DOI: 10.7270/Q28P6366
Hungarian Academy of Sciences Curated by ChEMBL					More data for this Ligand-Target Pair
Stromelysin-1 (Homo sapiens (Human))	BDBM50366038 (CHEMBL1356238) Show SMILES [O-][n+]1ccccc1S Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid UniChem Patents		n/a	n/a	3.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
D-amino-acid oxidase (Homo sapiens (Human))	BDBM36181 (SODIUM BENZOATE \| benzoate \| benzoic acid \| benzoi...) Show SMILES [O-]C(=O)c1ccccc1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.57E+4	n/a	n/a	n/a	n/a	n/a	n/a
Kitasato University Curated by ChEMBL					Assay Description Inhibition of human recombinant N-terminal His-tagged DAO expressed in Escherichia coli BL21(DE3) using D-alanine as substrate by colorimetric assay				J Med Chem 56: 1894-907 (2013) Article DOI: 10.1021/jm3017865 BindingDB Entry DOI: 10.7270/Q2H70H4P
Kitasato University Curated by ChEMBL					More data for this Ligand-Target Pair

<< First | Previous | Displayed 201 to 209 (of 209 total )

Activity Spreadsheet -- ITC Data from BindingDB

Found 5 hits for monomerid = 50381325,50366033,50366034,50366037,50366038,50378564,26978,36181
Cell (A)	Syringe (B)	Cell Links	Syringe Links	ΔG° kcal/mole	-TΔS° kcal/mole	ΔH° kcal/mole	log K	pH	Temp °C
BDBM36127	BDBM36181	PC cid PC sid	CHEBI KEGG PC cid PC sid	-2.51	-0.669	-1.83	1.84	6.90	25
Japan Science and Technology Agency	BDBM36181	PC cid PC sid	CHEBI KEGG PC cid PC sid	J Am Chem Soc 124: 12361-71 (2002)
BDBM36127	BDBM36181	PC cid PC sid	CHEBI KEGG PC cid PC sid	-2.58	-0.762	-1.83	1.89	6.90	25
Japan Science and Technology Agency	BDBM36181	PC cid PC sid	CHEBI KEGG PC cid PC sid	J Am Chem Soc 124: 12361-71 (2002)
BDBM36127	BDBM36181	PC cid PC sid	CHEBI KEGG PC cid PC sid	-2.46	-0.577	-1.89	1.81	6.90	25
Japan Science and Technology Agency	BDBM36181	PC cid PC sid	CHEBI KEGG PC cid PC sid	J Am Chem Soc 124: 12361-71 (2002)
BDBM36127	BDBM36181	PC cid PC sid	CHEBI KEGG PC cid PC sid	-2.55	-0.741	-1.82	1.87	6.90	25
Japan Science and Technology Agency	BDBM36181	PC cid PC sid	CHEBI KEGG PC cid PC sid	J Am Chem Soc 124: 12361-71 (2002)
BDBM11	BDBM36181	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI KEGG PC cid PC sid	-1.64	0.869	-2.51	1.20	6.90	25
NIST	BDBM36181	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI KEGG PC cid PC sid	J Phys Chem B 101: 87-100 (1997)