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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Luteinizing hormone/Choriogonadotropin receptor' and Ligand = 'BDBM50230128'   
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
Luteinizing hormone/Choriogonadotropin receptor


(Rattus norvegicus)
BDBM50230128
PNG
(CHEMBL437798)
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)N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CN(C)C(C)=O
Show InChI InChI=1S/C65H87N17O12/c1-7-69-61(91)54-19-13-25-82(54)64(94)48(18-12-24-70-65(66)67)75-57(87)49(26-37(2)3)76-59(89)51(28-40-31-71-46-16-10-8-14-44(40)46)77-58(88)50(27-39-20-22-43(85)23-21-39)78-62(92)55(35-83)81(6)63(93)53(29-41-32-72-47-17-11-9-15-45(41)47)79-60(90)52(30-42-33-68-36-73-42)74-56(86)34-80(5)38(4)84/h8-11,14-17,20-23,31-33,36-37,48-55,71-72,83,85H,7,12-13,18-19,24-30,34-35H2,1-6H3,(H,68,73)(H,69,91)(H,74,86)(H,75,87)(H,76,89)(H,77,88)(H,78,92)(H,79,90)(H4,66,67,70)/t48-,49-,50-,51+,52-,53-,54+,55-/m0/s1
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PC cid
PC sid
UniChem

Similars

Article
PubMed
0.380n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Negative logarithm of equilibrium dissociation constant in the rat pituitary luteinizing releasing hormone receptor binding assay


J Med Chem 35: 3890-4 (1992)


Article DOI: 10.1021/jm00099a017
More data for this
Ligand-Target Pair