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BDBM50320455 CHEMBL1163467::GTAD[CFWKYC]V

SMILES: CC(C)[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(O)=O

InChI Key: InChIKey=NUFGTERGVSMPEB-SWFTWZSLSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50320455   
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
UTS2R


(RAT)		BDBM50320455
PNG
(CHEMBL1163467 | GTAD[CFWKYC]V)
Show SMILES CC(C)[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(O)=O |r|
Show InChI InChI=1S/C59H79N13O16S2/c1-30(2)48(59(87)88)72-57(85)45-29-90-89-28-44(69-55(83)43(25-47(76)77)65-50(78)31(3)63-58(86)49(32(4)73)71-46(75)26-61)56(84)67-40(22-33-12-6-5-7-13-33)52(80)68-42(24-35-27-62-38-15-9-8-14-37(35)38)54(82)64-39(16-10-11-21-60)51(79)66-41(53(81)70-45)23-34-17-19-36(74)20-18-34/h5-9,12-15,17-20,27,30-32,39-45,48-49,62,73-74H,10-11,16,21-26,28-29,60-61H2,1-4H3,(H,63,86)(H,64,82)(H,65,78)(H,66,79)(H,67,84)(H,68,80)(H,69,83)(H,70,81)(H,71,75)(H,72,85)(H,76,77)(H,87,88)/t31-,32+,39-,40-,41-,42-,43-,44-,45-,48-,49-/m0/s1
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PubMed
n/an/an/an/a 0.290n/an/an/an/a



Johnson& Johnson Pharmaceutical Research& Development

Curated by ChEMBL


Assay Description
Agonist activity at rat urotensin 2 receptor expressed in CHO cells assessed as calcium mobilization by FLIPR

J Med Chem 53: 2695-708 (2010)


Article DOI: 10.1021/jm901294u
BindingDB Entry DOI: 10.7270/Q20G3K9N
More data for this
Ligand-Target Pair