BDBM50085727 CHEMBL385090::Cyclo (5-8) [Ac-D Nal, D Cpa, D Pal, Asp, Asp, D Pal, Leu, Amp, Pro, D Ala]GnRH

SMILES: CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]1CC(=O)Nc2ccc(C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc3cccnc3)NC1=O)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O)cc2

InChI Key: InChIKey=PCIBUHVDZAWXQX-BMRUJSFTSA-N

Data: 1 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 1 hit for monomerid = 50085727   

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
Gonadotropin-releasing hormone receptor (Rattus norvegicus)	BDBM50085727 (CHEMBL385090 | Cyclo (5-8) [Ac-D Nal, D Cpa, D Pal...) Show SMILES CC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]1CC(=O)Nc2ccc(C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc3cccnc3)NC1=O)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)C(N)=O)cc2 Show InChI InChI=1S/C62H77ClN14O14/c1-6-42(68-35(5)78)54(83)71-44(25-36-13-17-40(63)18-14-36)56(85)72-46(28-39-11-8-22-66-32-39)58(87)75-48(30-52(80)81)60(89)74-47-29-51(79)69-41-19-15-37(16-20-41)26-49(62(91)77-23-9-12-50(77)61(90)67-34(4)53(64)82)76-55(84)43(24-33(2)3)70-57(86)45(73-59(47)88)27-38-10-7-21-65-31-38/h7-8,10-11,13-22,31-34,42-50H,6,9,12,23-30H2,1-5H3,(H2,64,82)(H,67,90)(H,68,78)(H,69,79)(H,70,86)(H,71,83)(H,72,85)(H,73,88)(H,74,89)(H,75,87)(H,76,84)(H,80,81)/t34-,42-,43-,44-,45+,46-,47+,48-,49-,50+/m0/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Salk Institute Curated by ChEMBL					Assay Description Competitive radioligand binding assay, in human HEK-293 cells stably transfected with the rat Gonadotropin-releasing hormone receptor				J Med Chem 43: 784-96 (2000) BindingDB Entry DOI: 10.7270/Q2J38RS2
					More data for this Ligand-Target Pair