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SMILES: CCCC[C@@H](NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](N)Cc1ccccc1)C(=O)N[C@H](CNC(N)=N)C(=O)N1CCCN(CC1)C(N)=N

InChI Key: InChIKey=XCHCHSXNYFSMJH-BIYDSLDMSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 235806   
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
Kappa-type opioid receptor


(Mus musculus (Mouse))		BDBM235806
PNG
(US9359399, 19)
Show SMILES CCCC[C@@H](NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](N)Cc1ccccc1)C(=O)N[C@H](CNC(N)=N)C(=O)N1CCCN(CC1)C(N)=N |r|
Show InChI InChI=1S/C34H51N11O4/c1-2-3-15-26(30(47)43-28(22-40-33(36)37)32(49)44-16-10-17-45(19-18-44)34(38)39)41-31(48)27(21-24-13-8-5-9-14-24)42-29(46)25(35)20-23-11-6-4-7-12-23/h4-9,11-14,25-28H,2-3,10,15-22,35H2,1H3,(H3,38,39)(H,41,48)(H,42,46)(H,43,47)(H4,36,37,40)/t25-,26-,27-,28-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 2.15n/an/an/a25



Cara Therapeutics, Inc.

US Patent


Assay Description
Mouse R1.G1 cells (ATCC, Manassas, Va.) were grown in suspension in high glucose-DMEM (Dulbecco's Modified Eagle's Medium, Cellgro, Herndon, Va.) con...

US Patent US9359399 (2016)


BindingDB Entry DOI: 10.7270/Q23B5Z2C
More data for this
Ligand-Target Pair