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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Lutropin-choriogonadotropic hormone receptor' and Ligand = 'BDBM50405770'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Lutropin-choriogonadotropic hormone receptor


(Rattus norvegicus)		BDBM50405770
PNG
(CHEMBL216617)
Show SMILES CCNC(=O)C1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)CCc1cccc2ccccc12
Show InChI InChI=1S/C57H72N10O9/c1-4-60-55(75)49-19-11-29-67(49)56(76)44(18-10-28-61-57(58)59)63-51(71)45(30-35(2)3)64-53(73)47(33-37-20-23-38-12-5-6-14-41(38)31-37)65-52(72)46(32-36-21-25-42(69)26-22-36)66-54(74)48(34-68)62-50(70)27-24-40-16-9-15-39-13-7-8-17-43(39)40/h5-9,12-17,20-23,25-26,31,35,44-49,68-69H,4,10-11,18-19,24,27-30,32-34H2,1-3H3,(H,60,75)(H,62,70)(H,63,71)(H,64,73)(H,65,72)(H,66,74)(H4,58,59,61)/t44-,45-,46-,47+,48-,49?/m0/s1
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Similars
PubMed
 0.282n/an/an/an/an/an/an/an/a



Abbott Laboratory

Curated by ChEMBL


Assay Description
In vitro binding affinity for Luteinizing hormone releasing hormone receptor from rat pituitary cells, expressed as negative logarithm of the equilib...

J Med Chem 32: 2340-4 (1989)


BindingDB Entry DOI: 10.7270/Q2H70H1B
More data for this
Ligand-Target Pair