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SMILES: CCNC(=O)[C@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(C)=O

InChI Key: InChIKey=WHQBDVNEXKKJTH-SLXLDTPDSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50470126   
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)		BDBM50470126
PNG
(CHEMBL266032)
Show SMILES CCNC(=O)[C@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(C)=O |wU:57.63,12.20,77.91,wD:45.57,31.44,63.79,23.28,5.4,(17.4,.92,;17.4,-.62,;16.08,-1.39,;14.73,-.64,;13.42,-1.39,;14.7,.87,;15.92,1.76,;15.41,3.21,;13.87,3.21,;13.44,1.75,;12.1,.99,;12.09,-.55,;10.78,1.76,;10.79,3.33,;12.12,4.07,;12.14,5.61,;13.48,6.4,;13.48,7.92,;14.83,8.68,;12.16,8.71,;9.44,1.02,;8.09,1.79,;8.12,3.34,;6.75,1.03,;6.75,-.51,;8.08,-1.29,;9.41,-.52,;8.06,-2.83,;5.42,1.82,;4.08,1.05,;4.07,-.49,;2.76,1.83,;2.77,3.37,;2.29,4.83,;.83,5.31,;.83,6.86,;2.31,7.33,;2.93,8.75,;4.47,8.91,;5.37,7.66,;4.75,6.24,;3.21,6.08,;1.42,1.06,;.07,1.85,;.07,3.39,;-1.27,1.08,;-1.27,-.46,;.06,-1.23,;.04,-2.79,;1.38,-3.57,;2.73,-2.8,;4.05,-3.57,;2.74,-1.26,;1.39,-.48,;-2.59,1.88,;-3.93,1.11,;-3.95,-.45,;-5.26,1.89,;-5.25,3.42,;-3.91,4.19,;-6.61,1.12,;-7.94,1.91,;-7.92,3.45,;-9.29,1.14,;-9.29,-.4,;-7.98,-1.19,;-6.54,-.56,;-5.52,-1.71,;-6.31,-3.05,;-5.84,-4.52,;-6.89,-5.66,;-8.39,-5.34,;-8.85,-3.86,;-7.82,-2.73,;-10.61,1.91,;-11.95,1.15,;-11.99,-.38,;-13.28,1.95,;-13.27,3.49,;-11.92,4.26,;-11.95,5.8,;-10.57,6.54,;-9.26,5.77,;-9.26,4.23,;-10.61,3.46,;-14.62,1.18,;-15.82,2.14,;-17.24,1.56,;-15.6,3.65,)|
Show InChI InChI=1S/C64H82N14O11/c1-5-67-62(88)55-22-14-28-78(55)63(89)48(21-13-27-68-64(65)66)72-56(82)49(29-37(2)3)73-59(85)52(32-41-34-69-46-19-11-9-17-44(41)46)76-58(84)51(31-40-23-25-43(81)26-24-40)74-61(87)54(36-79)77-60(86)53(33-42-35-70-47-20-12-10-18-45(42)47)75-57(83)50(71-38(4)80)30-39-15-7-6-8-16-39/h6-12,15-20,23-26,34-35,37,48-55,69-70,79,81H,5,13-14,21-22,27-33,36H2,1-4H3,(H,67,88)(H,71,80)(H,72,82)(H,73,85)(H,74,87)(H,75,83)(H,76,84)(H,77,86)(H4,65,66,68)/t48-,49-,50-,51-,52+,53-,54-,55+/m0/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
 0.166n/an/an/an/an/an/an/an/a



TAP Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibition of the in vitro binding of [125I]-labeled leuprolide to the rat pituitary luteinizing hormone releasing hormone (LHRH) receptor.

J Med Chem 37: 701-5 (1994)


Article DOI: 10.1021/jm00031a021
BindingDB Entry DOI: 10.7270/Q2MG7S7B
More data for this
Ligand-Target Pair