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SMILES: CCCN(CCC)C1CCn2ncc(Cl)c2C1

InChI Key: InChIKey=SHBKBFYVWDZZMP-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 10 hits for monomerid = 50172507   

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))	BDBM50172507 ((3-Chloro-4,5,6,7-tetrahydro-pyrazolo[1,5-a]pyridi...) Show SMILES CCCN(CCC)C1CCn2ncc(Cl)c2C1 Show InChI InChI=1S/C13H22ClN3/c1-3-6-16(7-4-2)11-5-8-17-13(9-11)12(14)10-15-17/h10-11H,3-9H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich Alexander University Curated by ChEMBL					Assay Description High binding affinity towards human dopamine receptor 3 expressed in Chinese hamster ovary cells using [3H]spiperone (0.5 nM) as radioligand				J Med Chem 48: 5771-9 (2005) Article DOI: 10.1021/jm0503805 BindingDB Entry DOI: 10.7270/Q2KW5GT9
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50172507 ((3-Chloro-4,5,6,7-tetrahydro-pyrazolo[1,5-a]pyridi...) Show SMILES CCCN(CCC)C1CCn2ncc(Cl)c2C1 Show InChI InChI=1S/C13H22ClN3/c1-3-6-16(7-4-2)11-5-8-17-13(9-11)12(14)10-15-17/h10-11H,3-9H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	120	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich Alexander University Curated by ChEMBL					Assay Description High binding affinity towards human dopamine receptor 2 (long) expressed in Chinese hamster ovary cells using [3H]spiperone (0.5 nM) as radioligand				J Med Chem 48: 5771-9 (2005) Article DOI: 10.1021/jm0503805 BindingDB Entry DOI: 10.7270/Q2KW5GT9
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50172507 ((3-Chloro-4,5,6,7-tetrahydro-pyrazolo[1,5-a]pyridi...) Show SMILES CCCN(CCC)C1CCn2ncc(Cl)c2C1 Show InChI InChI=1S/C13H22ClN3/c1-3-6-16(7-4-2)11-5-8-17-13(9-11)12(14)10-15-17/h10-11H,3-9H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich Alexander University Curated by ChEMBL					Assay Description High binding affinity towards human dopamine receptor 4.4 expressed in Chinese hamster ovary cells using [3H]spiperone (0.5 nM) as radioligand				J Med Chem 48: 5771-9 (2005) Article DOI: 10.1021/jm0503805 BindingDB Entry DOI: 10.7270/Q2KW5GT9
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50172507 ((3-Chloro-4,5,6,7-tetrahydro-pyrazolo[1,5-a]pyridi...) Show SMILES CCCN(CCC)C1CCn2ncc(Cl)c2C1 Show InChI InChI=1S/C13H22ClN3/c1-3-6-16(7-4-2)11-5-8-17-13(9-11)12(14)10-15-17/h10-11H,3-9H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	210	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich Alexander University Curated by ChEMBL					Assay Description High binding affinity towards human dopamine receptor 2 (short) expressed in Chinese hamster ovary cells using [3H]spiperone (0.5 nM) as radioligand				J Med Chem 48: 5771-9 (2005) Article DOI: 10.1021/jm0503805 BindingDB Entry DOI: 10.7270/Q2KW5GT9
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50172507 ((3-Chloro-4,5,6,7-tetrahydro-pyrazolo[1,5-a]pyridi...) Show SMILES CCCN(CCC)C1CCn2ncc(Cl)c2C1 Show InChI InChI=1S/C13H22ClN3/c1-3-6-16(7-4-2)11-5-8-17-13(9-11)12(14)10-15-17/h10-11H,3-9H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	230	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich Alexander University Curated by ChEMBL					Assay Description Low binding affinity towards human dopamine receptor 3 expressed in Chinese hamster ovary cells using [3H]spiperone (0.5 nM) as radioligand				J Med Chem 48: 5771-9 (2005) Article DOI: 10.1021/jm0503805 BindingDB Entry DOI: 10.7270/Q2KW5GT9
					More data for this Ligand-Target Pair
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50172507 ((3-Chloro-4,5,6,7-tetrahydro-pyrazolo[1,5-a]pyridi...) Show SMILES CCCN(CCC)C1CCn2ncc(Cl)c2C1 Show InChI InChI=1S/C13H22ClN3/c1-3-6-16(7-4-2)11-5-8-17-13(9-11)12(14)10-15-17/h10-11H,3-9H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich Alexander University Curated by ChEMBL					Assay Description Low binding affinity towards human dopamine receptor 4.4 expressed in Chinese hamster ovary cells using [3H]spiperone (0.5 nM) as radioligand				J Med Chem 48: 5771-9 (2005) Article DOI: 10.1021/jm0503805 BindingDB Entry DOI: 10.7270/Q2KW5GT9
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50172507 ((3-Chloro-4,5,6,7-tetrahydro-pyrazolo[1,5-a]pyridi...) Show SMILES CCCN(CCC)C1CCn2ncc(Cl)c2C1 Show InChI InChI=1S/C13H22ClN3/c1-3-6-16(7-4-2)11-5-8-17-13(9-11)12(14)10-15-17/h10-11H,3-9H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich Alexander University Curated by ChEMBL					Assay Description Low binding affinity towards human dopamine receptor 2 (short) expressed in Chinese hamster ovary cells using [3H]spiperone (0.5 nM) as radioligand				J Med Chem 48: 5771-9 (2005) Article DOI: 10.1021/jm0503805 BindingDB Entry DOI: 10.7270/Q2KW5GT9
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50172507 ((3-Chloro-4,5,6,7-tetrahydro-pyrazolo[1,5-a]pyridi...) Show SMILES CCCN(CCC)C1CCn2ncc(Cl)c2C1 Show InChI InChI=1S/C13H22ClN3/c1-3-6-16(7-4-2)11-5-8-17-13(9-11)12(14)10-15-17/h10-11H,3-9H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich Alexander University Curated by ChEMBL					Assay Description Low binding affinity towards human dopamine receptor 2 (long) expressed in Chinese hamster ovary cells using [3H]spiperone (0.5 nM) as radioligand				J Med Chem 48: 5771-9 (2005) Article DOI: 10.1021/jm0503805 BindingDB Entry DOI: 10.7270/Q2KW5GT9
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (Sus scrofa)	BDBM50172507 ((3-Chloro-4,5,6,7-tetrahydro-pyrazolo[1,5-a]pyridi...) Show SMILES CCCN(CCC)C1CCn2ncc(Cl)c2C1 Show InChI InChI=1S/C13H22ClN3/c1-3-6-16(7-4-2)11-5-8-17-13(9-11)12(14)10-15-17/h10-11H,3-9H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich Alexander University Curated by ChEMBL					Assay Description Binding affinity (low) towards porcine dopamine receptor 1 by using [3H]-SCH- 23390 (0.3 nM) as radioligand				J Med Chem 48: 5771-9 (2005) Article DOI: 10.1021/jm0503805 BindingDB Entry DOI: 10.7270/Q2KW5GT9
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50172507 ((3-Chloro-4,5,6,7-tetrahydro-pyrazolo[1,5-a]pyridi...) Show SMILES CCCN(CCC)C1CCn2ncc(Cl)c2C1 Show InChI InChI=1S/C13H22ClN3/c1-3-6-16(7-4-2)11-5-8-17-13(9-11)12(14)10-15-17/h10-11H,3-9H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	4.5	n/a	n/a	n/a	n/a
Friedrich Alexander University Curated by ChEMBL					Assay Description Effective concentration against dopamine D3 receptor				J Med Chem 48: 5771-9 (2005) Article DOI: 10.1021/jm0503805 BindingDB Entry DOI: 10.7270/Q2KW5GT9
					More data for this Ligand-Target Pair