BindingDB logo
myBDB logout

null

SMILES: CCC(CO)(CO)NCc1cc(Cl)c(OCc2nccc(c2C)-c2cccc(OCCCN3CC[C@@H](O)C3)c2C)cc1OCc1cncc(c1)C#N

InChI Key: InChIKey=AKKBIEZYVLKDMU-JGCGQSQUSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 436170   
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
Programmed cell death protein 1


(Homo sapiens)		BDBM436170
PNG
(US10590105, Example 2013)
Show SMILES CCC(CO)(CO)NCc1cc(Cl)c(OCc2nccc(c2C)-c2cccc(OCCCN3CC[C@@H](O)C3)c2C)cc1OCc1cncc(c1)C#N |r|
Show InChI InChI=1S/C40H48ClN5O6/c1-4-40(25-47,26-48)45-21-31-16-35(41)39(17-38(31)51-23-30-15-29(18-42)19-43-20-30)52-24-36-27(2)34(9-11-44-36)33-7-5-8-37(28(33)3)50-14-6-12-46-13-10-32(49)22-46/h5,7-9,11,15-17,19-20,32,45,47-49H,4,6,10,12-14,21-26H2,1-3H3/t32-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 5n/an/an/an/an/an/a



Bristol-Meyers Squibb Company

US Patent


Assay Description
The interaction of PD-1 and PD-L1 can be assessed using soluble, purified preparations of the extracellular domains of the two proteins. The PD-1 and...

US Patent US10590105 (2020)

More data for this
Ligand-Target Pair