Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 356.4 BDBM42453Purchase

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 3 hits in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Neuropeptides B/W receptor type 1 (Homo sapiens (Human))	BDBM42453 (2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]-N-[1-...) Show SMILES [H]C12CCC([H])(C1)C(C2)C(C)NC(=O)Cn1c(NCCO)nc2ccccc12 |TLB:9:7:6:3.2| Show InChI InChI=1S/C20H28N4O2/c1-13(16-11-14-6-7-15(16)10-14)22-19(26)12-24-18-5-3-2-4-17(18)23-20(24)21-8-9-25/h2-5,13-16,25H,6-12H2,1H3,(H,21,23)(H,22,26)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.46E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2WH2NF9
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 1 (Homo sapiens (Human))	BDBM42453 (2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]-N-[1-...) Show SMILES [H]C12CCC([H])(C1)C(C2)C(C)NC(=O)Cn1c(NCCO)nc2ccccc12 |TLB:9:7:6:3.2| Show InChI InChI=1S/C20H28N4O2/c1-13(16-11-14-6-7-15(16)10-14)22-19(26)12-24-18-5-3-2-4-17(18)23-20(24)21-8-9-25/h2-5,13-16,25H,6-12H2,1H3,(H,21,23)(H,22,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	>3.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2ZS2TWK
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 2 (Homo sapiens (Human))	BDBM42453 (2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]-N-[1-...) Show SMILES [H]C12CCC([H])(C1)C(C2)C(C)NC(=O)Cn1c(NCCO)nc2ccccc12 |TLB:9:7:6:3.2| Show InChI InChI=1S/C20H28N4O2/c1-13(16-11-14-6-7-15(16)10-14)22-19(26)12-24-18-5-3-2-4-17(18)23-20(24)21-8-9-25/h2-5,13-16,25H,6-12H2,1H3,(H,21,23)(H,22,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	>3.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2V1235Z
					More data for this Ligand-Target Pair