BDBM50272908 4-(2-{N'-[(S)-2-Methyl-cyclohexylidene]-hydrazino}-thiazol-4-yl)-benzonitrile::CHEMBL1243401::CHEMBL456150

SMILES: C[C@H]1CCCCC1=NNc1nc(cs1)-c1ccc(cc1)C#N

InChI Key: InChIKey=URFCVNLIHMXZAL-LBPRGKRZSA-N

Data: 6 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 6 hits for monomerid = 50272908   

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))	BDBM50272908 (4-(2-{N'-[(S)-2-Methyl-cyclohexylidene]-hydrazino}...) Show SMILES C[C@H]1CCCCC1=NNc1nc(cs1)-c1ccc(cc1)C#N |r,w:7.8| Show InChI InChI=1S/C17H18N4S/c1-12-4-2-3-5-15(12)20-21-17-19-16(11-22-17)14-8-6-13(10-18)7-9-14/h6-9,11-12H,2-5H2,1H3,(H,19,21)/t12-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.22E+3	n/a	n/a	n/a	n/a	n/a	n/a
Università degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of human recombinant MAOA				J Med Chem 51: 4874-80 (2008) Article DOI: 10.1021/jm800132g BindingDB Entry DOI: 10.7270/Q27P8Z5J
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50272908 (4-(2-{N'-[(S)-2-Methyl-cyclohexylidene]-hydrazino}...) Show SMILES C[C@H]1CCCCC1=NNc1nc(cs1)-c1ccc(cc1)C#N |r,w:7.8| Show InChI InChI=1S/C17H18N4S/c1-12-4-2-3-5-15(12)20-21-17-19-16(11-22-17)14-8-6-13(10-18)7-9-14/h6-9,11-12H,2-5H2,1H3,(H,19,21)/t12-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	63.0	n/a	n/a	n/a	n/a	n/a	n/a
Università degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of human recombinant MAOB				J Med Chem 51: 4874-80 (2008) Article DOI: 10.1021/jm800132g BindingDB Entry DOI: 10.7270/Q27P8Z5J
					More data for this Ligand-Target Pair
Amine oxidase (flavin-containing) A (Homo sapiens (Human))	BDBM50272908 (4-(2-{N'-[(S)-2-Methyl-cyclohexylidene]-hydrazino}...) Show SMILES C[C@H]1CCCCC1=NNc1nc(cs1)-c1ccc(cc1)C#N |r,w:7.8| Show InChI InChI=1S/C17H18N4S/c1-12-4-2-3-5-15(12)20-21-17-19-16(11-22-17)14-8-6-13(10-18)7-9-14/h6-9,11-12H,2-5H2,1H3,(H,19,21)/t12-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.22E+3	n/a	n/a	n/a	n/a	n/a	n/a
Dipartimento di Chimica e Tecnologie del Farmaco Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of human recombinant MAOA expressed in baculovirus infected BTI-TN-5B1-4 insect cells assessed as hydrogen peroxide production from p-tyra...				Bioorg Med Chem 18: 5063-70 (2010) Article DOI: 10.1016/j.bmc.2010.05.070 BindingDB Entry DOI: 10.7270/Q22F7PD1
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50272908 (4-(2-{N'-[(S)-2-Methyl-cyclohexylidene]-hydrazino}...) Show SMILES C[C@H]1CCCCC1=NNc1nc(cs1)-c1ccc(cc1)C#N |r,w:7.8| Show InChI InChI=1S/C17H18N4S/c1-12-4-2-3-5-15(12)20-21-17-19-16(11-22-17)14-8-6-13(10-18)7-9-14/h6-9,11-12H,2-5H2,1H3,(H,19,21)/t12-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	63	n/a	n/a	n/a	n/a	n/a	n/a
Universita degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of human recombinant MAOB expressed in baculovirus infected insect BTI-TN-5B1-4 cells assessed as production of hydrogen peroxide from p-t...				J Med Chem 53: 6516-20 (2010) Article DOI: 10.1021/jm100120s BindingDB Entry DOI: 10.7270/Q26H4HNW
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50272908 (4-(2-{N'-[(S)-2-Methyl-cyclohexylidene]-hydrazino}...) Show SMILES C[C@H]1CCCCC1=NNc1nc(cs1)-c1ccc(cc1)C#N |r,w:7.8| Show InChI InChI=1S/C17H18N4S/c1-12-4-2-3-5-15(12)20-21-17-19-16(11-22-17)14-8-6-13(10-18)7-9-14/h6-9,11-12H,2-5H2,1H3,(H,19,21)/t12-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	63	n/a	n/a	n/a	n/a	n/a	n/a
Dipartimento di Chimica e Tecnologie del Farmaco Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of human recombinant MAOB expressed in baculovirus infected BTI-TN-5B1-4 insect cells assessed as hydrogen peroxide production from p-tyra...				Bioorg Med Chem 18: 5063-70 (2010) Article DOI: 10.1016/j.bmc.2010.05.070 BindingDB Entry DOI: 10.7270/Q22F7PD1
					More data for this Ligand-Target Pair
Amine oxidase (flavin-containing) A (Homo sapiens (Human))	BDBM50272908 (4-(2-{N'-[(S)-2-Methyl-cyclohexylidene]-hydrazino}...) Show SMILES C[C@H]1CCCCC1=NNc1nc(cs1)-c1ccc(cc1)C#N |r,w:7.8| Show InChI InChI=1S/C17H18N4S/c1-12-4-2-3-5-15(12)20-21-17-19-16(11-22-17)14-8-6-13(10-18)7-9-14/h6-9,11-12H,2-5H2,1H3,(H,19,21)/t12-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.22E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universita degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of human recombinant MAOA expressed in baculovirus infected insect BTI-TN-5B1-4 cells assessed as production of hydrogen peroxide from p-t...				J Med Chem 53: 6516-20 (2010) Article DOI: 10.1021/jm100120s BindingDB Entry DOI: 10.7270/Q26H4HNW
					More data for this Ligand-Target Pair