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BDBM50002530 Benzyloxycarbonyl-Gln-D-Trp(CHO)-Phe(isopropyloxy)::CHEMBL302844

SMILES: CC(C)OC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C=O)c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)OC(C)(C)C

InChI Key: InChIKey=NILHIHZZUYRAJS-VJGNERBWSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50002530   
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
Neurokinin 1 receptor


(GUINEA PIG)		BDBM50002530
PNG
(Benzyloxycarbonyl-Gln-D-Trp(CHO)-Phe(isopropyloxy)...)
Show SMILES CC(C)OC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1cn(C=O)c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)OC(C)(C)C
Show InChI InChI=1S/C34H43N5O8/c1-21(2)46-32(44)27(17-22-11-7-6-8-12-22)37-31(43)26(18-23-19-39(20-40)28-14-10-9-13-24(23)28)36-30(42)25(15-16-29(35)41)38-33(45)47-34(3,4)5/h6-14,19-21,25-27H,15-18H2,1-5H3,(H2,35,41)(H,36,42)(H,37,43)(H,38,45)/t25-,26+,27-/m0/s1
PDB
MMDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
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CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 1.70E+3n/an/an/an/an/an/a



Fujisawa Pharmaceutical Co., Ltd.

Curated by ChEMBL


Assay Description
Displacement of specific binding of [3H]SP to tachykinin receptor 1 from the isolated guinea pig tracheal strips

J Med Chem 35: 2015-25 (1992)


BindingDB Entry DOI: 10.7270/Q2WS8TVS
More data for this
Ligand-Target Pair