BDBM50085744 CHEMBL430344::dicyclo(1-3, 4-10)Ac-D-Asp-D-Cpa-D-Lys-Asp-Tyr-D-Nal-Leu-Arg-Pro-Dpr-NH2

SMILES: CC(C)C[C@@H]1NC(=O)C(Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(=O)NC(CNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CCCNC(N)=N)NC1=O)C(O)=O)NC(=O)C1CCCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)C(CC(=O)N1)NC(C)=O

InChI Key: InChIKey=WSTXSDSPBYUGGO-OGMORUQDSA-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 = 50085744   

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)	BDBM50085744 (CHEMBL430344 | dicyclo(1-3, 4-10)Ac-D-Asp-D-Cpa-D-...) Show SMILES CC(C)C[C@@H]1NC(=O)C(Cc2ccc3ccccc3c2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(=O)NC(CNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CCCNC(N)=N)NC1=O)C(O)=O)NC(=O)C1CCCCNC(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)C(CC(=O)N1)NC(C)=O Show InChI InChI=1S/C67H86ClN15O15/c1-36(2)28-47-59(90)77-46(13-8-26-72-67(69)70)65(96)83-27-9-14-54(83)64(95)73-35-53(66(97)98)76-56(87)34-52(63(94)80-49(31-39-18-23-44(85)24-19-39)60(91)81-50(61(92)78-47)32-40-15-20-41-10-4-5-11-42(41)29-40)82-58(89)45-12-6-7-25-71-57(88)48(30-38-16-21-43(68)22-17-38)79-62(93)51(74-37(3)84)33-55(86)75-45/h4-5,10-11,15-24,29,36,45-54,85H,6-9,12-14,25-28,30-35H2,1-3H3,(H,71,88)(H,73,95)(H,74,84)(H,75,86)(H,76,87)(H,77,90)(H,78,92)(H,79,93)(H,80,94)(H,81,91)(H,82,89)(H,97,98)(H4,69,70,72)/t45?,46-,47+,48-,49+,50?,51?,52+,53?,54+/m1/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.20	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 for rat Gonadotropin-releasing hormone receptor cells stably transfected in human HEK-293				J Med Chem 43: 797-806 (2000) BindingDB Entry DOI: 10.7270/Q2DF6QD5
					More data for this Ligand-Target Pair