BDBM50166523 CHEMBL195110::Pyrrolidine-1-carboxylic acid [(R)-1-(2,4-dichloro-benzyl)-2-oxo-2-(4-{2-[(2-thiophen-2-yl-ethylamino)-methyl]-phenyl}-piperazin-1-yl)-ethyl]-amide

SMILES: Clc1ccc(C[C@@H](NC(=O)N2CCCC2)C(=O)N2CCN(CC2)c2ccccc2CNCCc2cccs2)c(Cl)c1

InChI Key: InChIKey=VFJOTTZGMDRNPT-MUUNZHRXSA-N

Data: 4 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 4 hits for monomerid = 50166523   

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 4 (Homo sapiens (Human))	BDBM50166523 (CHEMBL195110 | Pyrrolidine-1-carboxylic acid [(R)-...) Show SMILES Clc1ccc(C[C@@H](NC(=O)N2CCCC2)C(=O)N2CCN(CC2)c2ccccc2CNCCc2cccs2)c(Cl)c1 Show InChI InChI=1S/C31H37Cl2N5O2S/c32-25-10-9-23(27(33)21-25)20-28(35-31(40)38-13-3-4-14-38)30(39)37-17-15-36(16-18-37)29-8-2-1-6-24(29)22-34-12-11-26-7-5-19-41-26/h1-2,5-10,19,21,28,34H,3-4,11-18,20,22H2,(H,35,40)/t28-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.5	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 melanocortin-4 receptor transfected in HEK 293 cells using [125I]-NDP-MSH as radioligand				Bioorg Med Chem Lett 15: 2541-6 (2005) Article DOI: 10.1016/j.bmcl.2005.03.053 BindingDB Entry DOI: 10.7270/Q22Z1527
					More data for this Ligand-Target Pair
Melanocortin receptor 5 (MC5R) (Homo sapiens (Human))	BDBM50166523 (CHEMBL195110 | Pyrrolidine-1-carboxylic acid [(R)-...) Show SMILES Clc1ccc(C[C@@H](NC(=O)N2CCCC2)C(=O)N2CCN(CC2)c2ccccc2CNCCc2cccs2)c(Cl)c1 Show InChI InChI=1S/C31H37Cl2N5O2S/c32-25-10-9-23(27(33)21-25)20-28(35-31(40)38-13-3-4-14-38)30(39)37-17-15-36(16-18-37)29-8-2-1-6-24(29)22-34-12-11-26-7-5-19-41-26/h1-2,5-10,19,21,28,34H,3-4,11-18,20,22H2,(H,35,40)/t28-/m1/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	160	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 at melanocortin-5 receptor stably transfected in HEK 293 cells using [125I]NDP-MSH as radiolabeled				Bioorg Med Chem Lett 15: 2541-6 (2005) Article DOI: 10.1016/j.bmcl.2005.03.053 BindingDB Entry DOI: 10.7270/Q22Z1527
					More data for this Ligand-Target Pair
Melanocortin receptor 3 (Homo sapiens (Human))	BDBM50166523 (CHEMBL195110 | Pyrrolidine-1-carboxylic acid [(R)-...) Show SMILES Clc1ccc(C[C@@H](NC(=O)N2CCCC2)C(=O)N2CCN(CC2)c2ccccc2CNCCc2cccs2)c(Cl)c1 Show InChI InChI=1S/C31H37Cl2N5O2S/c32-25-10-9-23(27(33)21-25)20-28(35-31(40)38-13-3-4-14-38)30(39)37-17-15-36(16-18-37)29-8-2-1-6-24(29)22-34-12-11-26-7-5-19-41-26/h1-2,5-10,19,21,28,34H,3-4,11-18,20,22H2,(H,35,40)/t28-/m1/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	670	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 melanocortin-3 receptor transfected in HEK 293 cells using [125I]NDP-MSH as radioligand				Bioorg Med Chem Lett 15: 2541-6 (2005) Article DOI: 10.1016/j.bmcl.2005.03.053 BindingDB Entry DOI: 10.7270/Q22Z1527
					More data for this Ligand-Target Pair
Melanocyte-stimulating hormone receptor (Homo sapiens (Human))	BDBM50166523 (CHEMBL195110 | Pyrrolidine-1-carboxylic acid [(R)-...) Show SMILES Clc1ccc(C[C@@H](NC(=O)N2CCCC2)C(=O)N2CCN(CC2)c2ccccc2CNCCc2cccs2)c(Cl)c1 Show InChI InChI=1S/C31H37Cl2N5O2S/c32-25-10-9-23(27(33)21-25)20-28(35-31(40)38-13-3-4-14-38)30(39)37-17-15-36(16-18-37)29-8-2-1-6-24(29)22-34-12-11-26-7-5-19-41-26/h1-2,5-10,19,21,28,34H,3-4,11-18,20,22H2,(H,35,40)/t28-/m1/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.90E+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 at melanocortin-1 receptor stably transfected in HEK 293 cells using [125I]NDP-MSH as radiolabeled				Bioorg Med Chem Lett 15: 2541-6 (2005) Article DOI: 10.1016/j.bmcl.2005.03.053 BindingDB Entry DOI: 10.7270/Q22Z1527
					More data for this Ligand-Target Pair