BDBM50498661 CHEMBL3621865

SMILES: CC(=O)N1CC(C1)n1cc(nn1)-c1cc(ccn1)C(O)=O

InChI Key: InChIKey=ZWYZYIJWJJUCJE-UHFFFAOYSA-N

Data: 7 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 7 hits for monomerid = 50498661   

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
Lysine-specific demethylase 4C (Homo sapiens (Human))	BDBM50498661 (CHEMBL3621865) Show SMILES CC(=O)N1CC(C1)n1cc(nn1)-c1cc(ccn1)C(O)=O Show InChI InChI=1S/C13H13N5O3/c1-8(19)17-5-10(6-17)18-7-12(15-16-18)11-4-9(13(20)21)2-3-14-11/h2-4,7,10H,5-6H2,1H3,(H,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.59E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Oxford Curated by ChEMBL					Assay Description Inhibition of KDM4C (unknown origin) using H3(1-21)K9Me3-GGK-biotin substrate incubated for 15 mins by alpha screen assay				Medchemcomm 5: 1879-1886 (2014) Article DOI: 10.1039/c4md00291a BindingDB Entry DOI: 10.7270/Q2KH0RBN
					More data for this Ligand-Target Pair
Homo sapiens lysine demethylase 2A (KDM2A) (Homo sapiens (Human))	BDBM50498661 (CHEMBL3621865) Show SMILES CC(=O)N1CC(C1)n1cc(nn1)-c1cc(ccn1)C(O)=O Show InChI InChI=1S/C13H13N5O3/c1-8(19)17-5-10(6-17)18-7-12(15-16-18)11-4-9(13(20)21)2-3-14-11/h2-4,7,10H,5-6H2,1H3,(H,20,21)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	<1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Oxford Curated by ChEMBL					Assay Description Inhibition of KDM2A (unknown origin) using Biotin-H3(28-48)K36Me2 and H3(28-48)K36Me2 substrates incubated for 30 mins by alpha screen assay				Medchemcomm 5: 1879-1886 (2014) Article DOI: 10.1039/c4md00291a BindingDB Entry DOI: 10.7270/Q2KH0RBN
					More data for this Ligand-Target Pair
Lysine-specific demethylase 6B (Homo sapiens (Human))	BDBM50498661 (CHEMBL3621865) Show SMILES CC(=O)N1CC(C1)n1cc(nn1)-c1cc(ccn1)C(O)=O Show InChI InChI=1S/C13H13N5O3/c1-8(19)17-5-10(6-17)18-7-12(15-16-18)11-4-9(13(20)21)2-3-14-11/h2-4,7,10H,5-6H2,1H3,(H,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	<1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Oxford Curated by ChEMBL					Assay Description Inhibition of KDM6B (unknown origin) using H3(21-44)K27Me3-GK-biotin substrate incubated for 5 mins by alpha screen assay				Medchemcomm 5: 1879-1886 (2014) Article DOI: 10.1039/c4md00291a BindingDB Entry DOI: 10.7270/Q2KH0RBN
					More data for this Ligand-Target Pair
Lysine-specific demethylase 3A (Homo sapiens (Human))	BDBM50498661 (CHEMBL3621865) Show SMILES CC(=O)N1CC(C1)n1cc(nn1)-c1cc(ccn1)C(O)=O Show InChI InChI=1S/C13H13N5O3/c1-8(19)17-5-10(6-17)18-7-12(15-16-18)11-4-9(13(20)21)2-3-14-11/h2-4,7,10H,5-6H2,1H3,(H,20,21)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.01E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Oxford Curated by ChEMBL					Assay Description Inhibition of KDM3A (unknown origin) using H3(1-21)K9Me2-GGK-biotin substrate incubated for 5 mins by alpha screen assay				Medchemcomm 5: 1879-1886 (2014) Article DOI: 10.1039/c4md00291a BindingDB Entry DOI: 10.7270/Q2KH0RBN
					More data for this Ligand-Target Pair
Lysine-specific demethylase 5C (Homo sapiens (Human))	BDBM50498661 (CHEMBL3621865) Show SMILES CC(=O)N1CC(C1)n1cc(nn1)-c1cc(ccn1)C(O)=O Show InChI InChI=1S/C13H13N5O3/c1-8(19)17-5-10(6-17)18-7-12(15-16-18)11-4-9(13(20)21)2-3-14-11/h2-4,7,10H,5-6H2,1H3,(H,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	631	n/a	n/a	n/a	n/a	n/a	n/a
University of Oxford Curated by ChEMBL					Assay Description Inhibition of KDM5C (unknown origin) using H3(1-21)K4Me3-GGK-biotin substrate incubated for 20 mins by alpha screen assay				Medchemcomm 5: 1879-1886 (2014) Article DOI: 10.1039/c4md00291a BindingDB Entry DOI: 10.7270/Q2KH0RBN
					More data for this Ligand-Target Pair
Lysine-specific demethylase 4A (Homo sapiens (Human))	BDBM50498661 (CHEMBL3621865) Show SMILES CC(=O)N1CC(C1)n1cc(nn1)-c1cc(ccn1)C(O)=O Show InChI InChI=1S/C13H13N5O3/c1-8(19)17-5-10(6-17)18-7-12(15-16-18)11-4-9(13(20)21)2-3-14-11/h2-4,7,10H,5-6H2,1H3,(H,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.51E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Oxford Curated by ChEMBL					Assay Description Inhibition of KDM4A (unknown origin) using H3(1-21)K9Me3-GGK-biotin substrate by alpha screen assay				Medchemcomm 5: 1879-1886 (2014) Article DOI: 10.1039/c4md00291a BindingDB Entry DOI: 10.7270/Q2KH0RBN
					More data for this Ligand-Target Pair
Histone Lysine Demethylase (Homo sapiens (Human))	BDBM50498661 (CHEMBL3621865) Show SMILES CC(=O)N1CC(C1)n1cc(nn1)-c1cc(ccn1)C(O)=O Show InChI InChI=1S/C13H13N5O3/c1-8(19)17-5-10(6-17)18-7-12(15-16-18)11-4-9(13(20)21)2-3-14-11/h2-4,7,10H,5-6H2,1H3,(H,20,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.01E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Oxford Curated by ChEMBL					Assay Description Inhibition of KDM4E (unknown origin) by alpha screen assay				Medchemcomm 5: 1879-1886 (2014) Article DOI: 10.1039/c4md00291a BindingDB Entry DOI: 10.7270/Q2KH0RBN
					More data for this Ligand-Target Pair