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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Programmed cell death 1 ligand 1' and Ligand = 'BDBM482309'   
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
Programmed cell death 1 ligand 1


(Homo sapiens (Human))
BDBM482309
PNG
(US10919852, Compound TABLE 1.8 | US11708326, Compo...)
Show SMILES CCOc1cc(O[C@H]2CCc3c2cccc3-c2cccc(OCCCN3CCC(O)CC3)c2C)c(Cl)cc1CN[C@@H]([C@@H](C)O)C(O)=O |r|
Show InChI InChI=1S/C37H47ClN2O7/c1-4-45-34-21-35(31(38)20-25(34)22-39-36(24(3)41)37(43)44)47-33-13-12-29-28(9-5-10-30(29)33)27-8-6-11-32(23(27)2)46-19-7-16-40-17-14-26(42)15-18-40/h5-6,8-11,20-21,24,26,33,36,39,41-42H,4,7,12-19,22H2,1-3H3,(H,43,44)/t24-,33+,36+/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a<5n/an/an/an/an/an/a


TBA



Citation and Details

BindingDB Entry DOI: 10.7270/Q22N56DJ
More data for this
Ligand-Target Pair