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BDBM50085707 CHEMBL411197::Cyclo (4-10) [Ac-Delta Pro, D Fpa, D Trp, Asp, MeTyr, D Nal, Leu, Lys, Pro, Dpr]GnRH

SMILES: CC(C)C[C@H]1NC(=O)[C@H](C)NC(=O)[C@@](C)(Cc2ccc(O)cc2)NC(=O)[C@@H](CC(=O)NCC(NC(=O)[C@H]2CCCN2C(=O)[C@H](CCCCN)NC1=O)C(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)[C@@H]1CCCN1C(C)=O

InChI Key: InChIKey=ALUNLKNEIZXBJU-MUJGHXNLSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50085707   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Gonadotropin-releasing hormone receptor


(Rattus norvegicus)		BDBM50085707
PNG
(CHEMBL411197 | Cyclo (4-10) [Ac-Delta Pro, D Fpa, ...)
Show SMILES CC(C)C[C@H]1NC(=O)[C@H](C)NC(=O)[C@@](C)(Cc2ccc(O)cc2)NC(=O)[C@@H](CC(=O)NCC(NC(=O)[C@H]2CCCN2C(=O)[C@H](CCCCN)NC1=O)C(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)[C@@H]1CCCN1C(C)=O
Show InChI InChI=1S/C64H85FN14O13/c1-35(2)28-46-56(85)71-45(14-8-9-25-66)62(91)79-27-11-16-52(79)61(90)76-50(54(67)83)34-69-53(82)31-49(59(88)77-64(5,32-39-19-23-42(81)24-20-39)63(92)70-36(3)55(84)72-46)74-58(87)48(30-40-33-68-44-13-7-6-12-43(40)44)73-57(86)47(29-38-17-21-41(65)22-18-38)75-60(89)51-15-10-26-78(51)37(4)80/h6-7,12-13,17-24,33,35-36,45-52,68,81H,8-11,14-16,25-32,34,66H2,1-5H3,(H2,67,83)(H,69,82)(H,70,92)(H,71,85)(H,72,84)(H,73,86)(H,74,87)(H,75,89)(H,76,90)(H,77,88)/t36-,45-,46+,47-,48-,49+,50?,51-,52+,64+/m0/s1
KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
PubMed
 0.740n/an/an/an/an/an/an/an/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