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SMILES: N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCCCCCCCCCCCC(=O)N[C@@H](CO)C(=O)N1CCc2ccccc2C1C(=O)N1CC(C2CCCCC12)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O

InChI Key: InChIKey=JKBYANNHFXSVGO-POJJKISLSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50036834   
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
B2 bradykinin receptor


(Cavia porcellus)		BDBM50036834
PNG
(CHEMBL262639 | D-Arg-Arg-(12-aminododecanoyl)-Ser-...)
Show SMILES N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCCCCCCCCCCCC(=O)N[C@@H](CO)C(=O)N1CCc2ccccc2C1C(=O)N1CC(C2CCCCC12)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O
Show InChI InChI=1S/C52H88N16O9/c53-37(20-14-27-61-50(54)55)45(72)65-38(21-15-28-62-51(56)57)46(73)60-26-13-7-5-3-1-2-4-6-8-24-42(70)64-40(32-69)47(74)67-30-25-33-17-9-10-18-34(33)43(67)48(75)68-31-36(35-19-11-12-23-41(35)68)44(71)66-39(49(76)77)22-16-29-63-52(58)59/h9-10,17-18,35-41,43,69H,1-8,11-16,19-32,53H2,(H,60,73)(H,64,70)(H,65,72)(H,66,71)(H,76,77)(H4,54,55,61)(H4,56,57,62)(H4,58,59,63)/t35?,36?,37-,38-,39-,40-,41?,43?/m0/s1
MMDB

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 360n/an/an/an/an/an/an/an/a



Scios Nova Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards bradykinin receptor B2 using [3H]-bradykinin

J Med Chem 37: 1347-54 (1994)


BindingDB Entry DOI: 10.7270/Q200014T
More data for this
Ligand-Target Pair