BDBM10998 (1S)-2,3-dihydro-1H-inden-1-amine::1(S)-aminoindan::S-AI::rasagiline analog

SMILES: N[C@H]1CCc2ccccc12

InChI Key: InChIKey=XJEVHMGJSYVQBQ-VIFPVBQESA-N

Data: 2 KI

PDB links: 1 PDB ID matches this monomer. 2 PDB IDs contain this monomer as substructures. 3 PDB IDs contain inhibitors having a similarity of 90% to this monomer.

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 = 10998   

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))	BDBM10998 ((1S)-2,3-dihydro-1H-inden-1-amine | 1(S)-aminoinda...) Show SMILES N[C@H]1CCc2ccccc12 |r| Show InChI InChI=1S/C9H11N/c10-9-6-5-7-3-1-2-4-8(7)9/h1-4,9H,5-6,10H2/t9-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid PDB UniChem Patents Similars	Article PubMed	1.60E+5	-5.17	n/a	n/a	n/a	n/a	n/a	7.5	25
University of Pavia					Assay Description MAO A and MAO B activities were determined spectrophotometrically at 316 nm and 250 nm using kynuramine and benzylamine as substrates, respectively. ...				J Med Chem 48: 8148-54 (2005) Article DOI: 10.1021/jm0506266 BindingDB Entry DOI: 10.7270/Q2T151WC
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM10998 ((1S)-2,3-dihydro-1H-inden-1-amine | 1(S)-aminoinda...) Show SMILES N[C@H]1CCc2ccccc12 |r| Show InChI InChI=1S/C9H11N/c10-9-6-5-7-3-1-2-4-8(7)9/h1-4,9H,5-6,10H2/t9-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid PDB UniChem Patents Similars	Article PubMed	1.08E+6	-4.04	n/a	n/a	n/a	n/a	n/a	7.5	25
University of Pavia					Assay Description MAO A and MAO B activities were determined spectrophotometrically at 316 nm and 250 nm using kynuramine and benzylamine as substrates, respectively. ...				J Med Chem 48: 8148-54 (2005) Article DOI: 10.1021/jm0506266 BindingDB Entry DOI: 10.7270/Q2T151WC
					More data for this Ligand-Target Pair