BDBM50174881 Bu-Apc-DPhe-Arg-2-Nal-Z2-NH2::CHEMBL372789

SMILES: CCCC(=O)N[C@@]1(CC[C@@H](CC1)c1ccccc1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)NC(Cc1ccc2ccccc2c1)C(=O)NCC(N)=O

InChI Key: InChIKey=YUPUPXKFTROGRC-KEOHMXKYSA-N

Data: 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 1 hit for monomerid = 50174881   

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))	BDBM50174881 (Bu-Apc-DPhe-Arg-2-Nal-Z2-NH2 | CHEMBL372789) Show SMILES CCCC(=O)N[C@@]1(CC[C@@H](CC1)c1ccccc1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)NC(Cc1ccc2ccccc2c1)C(=O)NCC(N)=O |wU:21.22,32.34,9.12,6.5,wD:6.19,(-7.12,-4.64,;-5.79,-3.88,;-4.46,-4.64,;-3.12,-3.88,;-3.12,-2.33,;-1.78,-4.64,;-.44,-3.87,;.9,-3.11,;.89,-1.58,;-.43,-.8,;-1.76,-1.57,;-1.77,-3.11,;-.42,.72,;.91,1.49,;.91,3.02,;-.41,3.8,;-1.75,3.03,;-1.74,1.49,;.89,-4.64,;.89,-6.19,;2.23,-3.88,;3.56,-4.64,;3.56,-6.19,;4.9,-6.96,;4.89,-8.51,;6.23,-9.27,;7.56,-8.51,;7.56,-6.95,;6.22,-6.19,;4.9,-3.88,;4.9,-2.33,;6.23,-4.64,;7.57,-3.88,;7.57,-2.33,;8.91,-1.55,;8.91,-.01,;10.24,.76,;10.24,2.3,;11.59,3.08,;8.91,3.08,;8.91,-4.64,;8.91,-6.19,;10.24,-3.88,;11.59,-4.64,;11.59,-6.19,;12.92,-6.96,;14.25,-6.19,;15.59,-6.96,;15.59,-8.51,;16.92,-9.29,;16.92,-10.83,;15.57,-11.6,;14.24,-10.82,;14.25,-9.28,;12.91,-8.51,;12.92,-3.88,;12.92,-2.33,;14.26,-4.64,;15.59,-3.87,;16.92,-4.63,;18.25,-3.86,;16.92,-6.17,)| Show InChI InChI=1S/C47H59N9O6/c1-2-12-41(58)56-47(24-22-35(23-25-47)33-15-7-4-8-16-33)45(62)55-39(28-31-13-5-3-6-14-31)44(61)53-37(19-11-26-51-46(49)50)43(60)54-38(42(59)52-30-40(48)57)29-32-20-21-34-17-9-10-18-36(34)27-32/h3-10,13-18,20-21,27,35,37-39H,2,11-12,19,22-26,28-30H2,1H3,(H2,48,57)(H,52,59)(H,53,61)(H,54,60)(H,55,62)(H,56,58)(H4,49,50,51)/t35-,37-,38?,39+,47+/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	44	n/a	n/a	n/a	n/a
Roche Research Center Curated by ChEMBL					Assay Description Agonist activity in HEK293 cells transfected with human MC4R by cAMP accumulation				Bioorg Med Chem Lett 15: 5504-8 (2005) Article DOI: 10.1016/j.bmcl.2005.08.083 BindingDB Entry DOI: 10.7270/Q2MC8ZK7
					More data for this Ligand-Target Pair