BDBM50150836 4-(N''-Cyclohexyl-N''''-pyrrolidin-3-yl-guanidino)-N-[2-(2,4-dichloro-phenyl)-ethyl]-benzamide::CHEMBL186339

SMILES: Clc1ccc(CCNC(=O)c2ccc(NC(NC3CCNC3)=NC3CCCCC3)cc2)c(Cl)c1

InChI Key: InChIKey=PDXOBKQWULUDRV-UHFFFAOYSA-N

Data: 4 KI  1 IC50

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 = 50150836   

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
Melanocortin receptor 5 (MC5R) (Homo sapiens (Human))	BDBM50150836 (4-(N''-Cyclohexyl-N''''-pyrrolidin-3-yl-guanidino)...) Show SMILES Clc1ccc(CCNC(=O)c2ccc(NC(NC3CCNC3)=NC3CCCCC3)cc2)c(Cl)c1 |w:22.23| Show InChI InChI=1S/C26H33Cl2N5O/c27-20-9-6-18(24(28)16-20)12-15-30-25(34)19-7-10-22(11-8-19)32-26(33-23-13-14-29-17-23)31-21-4-2-1-3-5-21/h6-11,16,21,23,29H,1-5,12-15,17H2,(H,30,34)(H2,31,32,33)	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	26	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences, Inc. Curated by ChEMBL					Assay Description Inhibition of [125I]-NDP-MSH binding to human Melanocortin 5 receptor expressed in HEK-293 cells				J Med Chem 47: 4083-8 (2004) Article DOI: 10.1021/jm0400496 BindingDB Entry DOI: 10.7270/Q2JH3KM0
					More data for this Ligand-Target Pair
Melanocortin receptor 4 (Homo sapiens (Human))	BDBM50150836 (4-(N''-Cyclohexyl-N''''-pyrrolidin-3-yl-guanidino)...) Show SMILES Clc1ccc(CCNC(=O)c2ccc(NC(NC3CCNC3)=NC3CCCCC3)cc2)c(Cl)c1 |w:22.23| Show InChI InChI=1S/C26H33Cl2N5O/c27-20-9-6-18(24(28)16-20)12-15-30-25(34)19-7-10-22(11-8-19)32-26(33-23-13-14-29-17-23)31-21-4-2-1-3-5-21/h6-11,16,21,23,29H,1-5,12-15,17H2,(H,30,34)(H2,31,32,33)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences, Inc. Curated by ChEMBL					Assay Description Binding affinity for human melanocortin 4 receptor				J Med Chem 47: 4083-8 (2004) Article DOI: 10.1021/jm0400496 BindingDB Entry DOI: 10.7270/Q2JH3KM0
					More data for this Ligand-Target Pair
Melanocyte-stimulating hormone receptor (Homo sapiens (Human))	BDBM50150836 (4-(N''-Cyclohexyl-N''''-pyrrolidin-3-yl-guanidino)...) Show SMILES Clc1ccc(CCNC(=O)c2ccc(NC(NC3CCNC3)=NC3CCCCC3)cc2)c(Cl)c1 |w:22.23| Show InChI InChI=1S/C26H33Cl2N5O/c27-20-9-6-18(24(28)16-20)12-15-30-25(34)19-7-10-22(11-8-19)32-26(33-23-13-14-29-17-23)31-21-4-2-1-3-5-21/h6-11,16,21,23,29H,1-5,12-15,17H2,(H,30,34)(H2,31,32,33)	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences, Inc. Curated by ChEMBL					Assay Description Binding affinity for human melanocortin 1 receptor				J Med Chem 47: 4083-8 (2004) Article DOI: 10.1021/jm0400496 BindingDB Entry DOI: 10.7270/Q2JH3KM0
					More data for this Ligand-Target Pair
Melanocortin receptor 3 (Homo sapiens (Human))	BDBM50150836 (4-(N''-Cyclohexyl-N''''-pyrrolidin-3-yl-guanidino)...) Show SMILES Clc1ccc(CCNC(=O)c2ccc(NC(NC3CCNC3)=NC3CCCCC3)cc2)c(Cl)c1 |w:22.23| Show InChI InChI=1S/C26H33Cl2N5O/c27-20-9-6-18(24(28)16-20)12-15-30-25(34)19-7-10-22(11-8-19)32-26(33-23-13-14-29-17-23)31-21-4-2-1-3-5-21/h6-11,16,21,23,29H,1-5,12-15,17H2,(H,30,34)(H2,31,32,33)	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences, Inc. Curated by ChEMBL					Assay Description Binding affinity for human melanocortin 3 receptor				J Med Chem 47: 4083-8 (2004) Article DOI: 10.1021/jm0400496 BindingDB Entry DOI: 10.7270/Q2JH3KM0
					More data for this Ligand-Target Pair
Melanocortin receptor 5 (MC5R) (Homo sapiens (Human))	BDBM50150836 (4-(N''-Cyclohexyl-N''''-pyrrolidin-3-yl-guanidino)...) Show SMILES Clc1ccc(CCNC(=O)c2ccc(NC(NC3CCNC3)=NC3CCCCC3)cc2)c(Cl)c1 |w:22.23| Show InChI InChI=1S/C26H33Cl2N5O/c27-20-9-6-18(24(28)16-20)12-15-30-25(34)19-7-10-22(11-8-19)32-26(33-23-13-14-29-17-23)31-21-4-2-1-3-5-21/h6-11,16,21,23,29H,1-5,12-15,17H2,(H,30,34)(H2,31,32,33)	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	530	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences, Inc. Curated by ChEMBL					Assay Description Inhibition of [125I]NDP-MSH binding to human Melanocortin 5 receptor expressed in HEK293 cells				J Med Chem 47: 4083-8 (2004) Article DOI: 10.1021/jm0400496 BindingDB Entry DOI: 10.7270/Q2JH3KM0
					More data for this Ligand-Target Pair