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BDBM50002567 2-[1-[1-amino-2-(1H-3-indolyl)-(1R)-ethylcarboxamido]-2-phenyl-(1S)-ethylcarboxamido]-3-(1H-3-indolyl)-(2R)-propanoic acid::CHEMBL64601

SMILES: N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(O)=O

InChI Key: InChIKey=OTJDEIZGUFRGLL-FQLPYIGMSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50002567   
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)		BDBM50002567
PNG
(2-[1-[1-amino-2-(1H-3-indolyl)-(1R)-ethylcarboxami...)
Show SMILES N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1S/C31H31N5O4/c32-24(15-20-17-33-25-12-6-4-10-22(20)25)29(37)35-27(14-19-8-2-1-3-9-19)30(38)36-28(31(39)40)16-21-18-34-26-13-7-5-11-23(21)26/h1-13,17-18,24,27-28,33-34H,14-16,32H2,(H,35,37)(H,36,38)(H,39,40)/t24-,27+,28-/m1/s1
PDB
MMDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

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CHEMBL
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PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 1.00E+5n/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