BDBM50277041 2-{(1H-Pyrrolo[2,3-b]pyridin-3-yl)methyl}-5-(4-chlorophenyl)-2,5-diazabicyclo[2.2.1]heptane::CHEMBL514747

SMILES: Clc1ccc(cc1)N1CC2CC1CN2Cc1c[nH]c2ncccc12

InChI Key: InChIKey=YOODWDNGWLMMGG-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50277041   

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
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50277041 (2-{(1H-Pyrrolo[2,3-b]pyridin-3-yl)methyl}-5-(4-chl...) Show SMILES Clc1ccc(cc1)N1CC2CC1CN2Cc1c[nH]c2ncccc12 |TLB:4:7:10:13.12,THB:14:13:7.8:10| Show InChI InChI=1S/C19H19ClN4/c20-14-3-5-15(6-4-14)24-12-16-8-17(24)11-23(16)10-13-9-22-19-18(13)2-1-7-21-19/h1-7,9,16-17H,8,10-12H2,(H,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Florida A&M University Curated by ChEMBL					Assay Description Displacement of [3H]N-methylspiperone from human dopamine D3 receptor by liquid scintillation counting				Bioorg Med Chem 17: 1716-23 (2009) Article DOI: 10.1016/j.bmc.2008.12.054 BindingDB Entry DOI: 10.7270/Q2NG4QGT
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50277041 (2-{(1H-Pyrrolo[2,3-b]pyridin-3-yl)methyl}-5-(4-chl...) Show SMILES Clc1ccc(cc1)N1CC2CC1CN2Cc1c[nH]c2ncccc12 |TLB:4:7:10:13.12,THB:14:13:7.8:10| Show InChI InChI=1S/C19H19ClN4/c20-14-3-5-15(6-4-14)24-12-16-8-17(24)11-23(16)10-13-9-22-19-18(13)2-1-7-21-19/h1-7,9,16-17H,8,10-12H2,(H,21,22)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	62	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Florida A&M University Curated by ChEMBL					Assay Description Displacement of [3H]N-methylspiperone from human dopamine D2 receptor by liquid scintillation counting				Bioorg Med Chem 17: 1716-23 (2009) Article DOI: 10.1016/j.bmc.2008.12.054 BindingDB Entry DOI: 10.7270/Q2NG4QGT
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50277041 (2-{(1H-Pyrrolo[2,3-b]pyridin-3-yl)methyl}-5-(4-chl...) Show SMILES Clc1ccc(cc1)N1CC2CC1CN2Cc1c[nH]c2ncccc12 |TLB:4:7:10:13.12,THB:14:13:7.8:10| Show InChI InChI=1S/C19H19ClN4/c20-14-3-5-15(6-4-14)24-12-16-8-17(24)11-23(16)10-13-9-22-19-18(13)2-1-7-21-19/h1-7,9,16-17H,8,10-12H2,(H,21,22)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	69	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Florida A&M University Curated by ChEMBL					Assay Description Displacement of [125I]DOI from human dopamine D4 receptor by liquid scintillation counting				Bioorg Med Chem 17: 1716-23 (2009) Article DOI: 10.1016/j.bmc.2008.12.054 BindingDB Entry DOI: 10.7270/Q2NG4QGT
					More data for this Ligand-Target Pair