BDBM123819 4,5-dibromo-N'-(3,4-dihydroxybenzylidene)-1Hpyrrole-2-carbohydrazide (4f)

SMILES: Oc1ccc(C=NNC(=O)c2cc(Br)c(Br)[nH]2)cc1O

InChI Key: InChIKey=APRISDUNRWLFIJ-PJQLUOCWSA-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 = 123819   

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
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM123819 (4,5-dibromo-N'-(3,4-dihydroxybenzylidene)-1Hpy...) Show SMILES Oc1ccc(C=NNC(=O)c2cc(Br)c(Br)[nH]2)cc1O |w:6.6| Show InChI InChI=1S/C12H9Br2N3O3/c13-7-4-8(16-11(7)14)12(20)17-15-5-6-1-2-9(18)10(19)3-6/h1-5,16,18-19H,(H,17,20)/b15-5+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	1.73E+4	-6.75	n/a	n/a	n/a	n/a	n/a	7.4	37
University of KwaZulu-Natal					Assay Description The reaction mixtures (200 uL), containing recombinant human MAO-A or MAO-B (5 ug/mL) and the test compounds in potassium phosphate buffer (100 mM; p...				Chem Biol Drug Des 84: 593-602 (2014) Article DOI: 10.1111/cbdd.12352 BindingDB Entry DOI: 10.7270/Q2RB738C
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM123819 (4,5-dibromo-N'-(3,4-dihydroxybenzylidene)-1Hpy...) Show SMILES Oc1ccc(C=NNC(=O)c2cc(Br)c(Br)[nH]2)cc1O |w:6.6| Show InChI InChI=1S/C12H9Br2N3O3/c13-7-4-8(16-11(7)14)12(20)17-15-5-6-1-2-9(18)10(19)3-6/h1-5,16,18-19H,(H,17,20)/b15-5+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	4.48E+4	-6.17	n/a	n/a	n/a	n/a	n/a	7.4	37
University of KwaZulu-Natal					Assay Description The reaction mixtures (200 uL), containing recombinant human MAO-A or MAO-B (5 ug/mL) and the test compounds in potassium phosphate buffer (100 mM; p...				Chem Biol Drug Des 84: 593-602 (2014) Article DOI: 10.1111/cbdd.12352 BindingDB Entry DOI: 10.7270/Q2RB738C
					More data for this Ligand-Target Pair