BDBM50130442 CHEMBL105722::Pyridine-2-carboxylic acid [3-(1-methyl-piperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-amide

SMILES: CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccccn3)nc12

InChI Key: InChIKey=SVTBFKBDZPYGIL-UHFFFAOYSA-N

Data: 4 KI  1 EC50

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 5 hits for monomerid = 50130442   

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
Serotonin (5-HT) receptor (Homo sapiens (Human))	BDBM50130442 (CHEMBL105722 | Pyridine-2-carboxylic acid [3-(1-me...) Show SMILES CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccccn3)nc12 Show InChI InChI=1S/C19H21N5O/c1-24-10-7-13(8-11-24)14-12-21-15-5-6-17(22-18(14)15)23-19(25)16-4-2-3-9-20-16/h2-6,9,12-13,21H,7-8,10-11H2,1H3,(H,22,23,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	6.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description In vitro binding affinity was determined by radioligand binding assay using cell line expressing human 5-hydroxytryptamine 1F receptor				J Med Chem 46: 3060-71 (2003) Article DOI: 10.1021/jm030020m BindingDB Entry DOI: 10.7270/Q21V5DCB
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50130442 (CHEMBL105722 | Pyridine-2-carboxylic acid [3-(1-me...) Show SMILES CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccccn3)nc12 Show InChI InChI=1S/C19H21N5O/c1-24-10-7-13(8-11-24)14-12-21-15-5-6-17(22-18(14)15)23-19(25)16-4-2-3-9-20-16/h2-6,9,12-13,21H,7-8,10-11H2,1H3,(H,22,23,25)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	41	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description In vitro binding affinity of the compound was determined by radioligand binding assay using cell line expressing human 5-hydroxytryptamine 1A recepto...				J Med Chem 46: 3060-71 (2003) Article DOI: 10.1021/jm030020m BindingDB Entry DOI: 10.7270/Q21V5DCB
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1D (Homo sapiens (Human))	BDBM50130442 (CHEMBL105722 | Pyridine-2-carboxylic acid [3-(1-me...) Show SMILES CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccccn3)nc12 Show InChI InChI=1S/C19H21N5O/c1-24-10-7-13(8-11-24)14-12-21-15-5-6-17(22-18(14)15)23-19(25)16-4-2-3-9-20-16/h2-6,9,12-13,21H,7-8,10-11H2,1H3,(H,22,23,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	820	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description In vitro binding affinity of the compound was determined by radioligand binding assay using cell line expressing human 5-hydroxytryptamine 1D recepto...				J Med Chem 46: 3060-71 (2003) Article DOI: 10.1021/jm030020m BindingDB Entry DOI: 10.7270/Q21V5DCB
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1B (Homo sapiens (Human))	BDBM50130442 (CHEMBL105722 | Pyridine-2-carboxylic acid [3-(1-me...) Show SMILES CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccccn3)nc12 Show InChI InChI=1S/C19H21N5O/c1-24-10-7-13(8-11-24)14-12-21-15-5-6-17(22-18(14)15)23-19(25)16-4-2-3-9-20-16/h2-6,9,12-13,21H,7-8,10-11H2,1H3,(H,22,23,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description In vitro binding affinity of the compound was determined by radioligand binding assay using cell line expressing human 5-hydroxytryptamine 1B recepto...				J Med Chem 46: 3060-71 (2003) Article DOI: 10.1021/jm030020m BindingDB Entry DOI: 10.7270/Q21V5DCB
					More data for this Ligand-Target Pair
Serotonin (5-HT) receptor (Homo sapiens (Human))	BDBM50130442 (CHEMBL105722 | Pyridine-2-carboxylic acid [3-(1-me...) Show SMILES CN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccccn3)nc12 Show InChI InChI=1S/C19H21N5O/c1-24-10-7-13(8-11-24)14-12-21-15-5-6-17(22-18(14)15)23-19(25)16-4-2-3-9-20-16/h2-6,9,12-13,21H,7-8,10-11H2,1H3,(H,22,23,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	25	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description In vitro effective concentration for stimulation of [35S]-GTP-gammaS, binding in mouse LM(tk-)cells expressing the human 5-hydroxytryptamine 1F recep...				J Med Chem 46: 3060-71 (2003) Article DOI: 10.1021/jm030020m BindingDB Entry DOI: 10.7270/Q21V5DCB
					More data for this Ligand-Target Pair