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BDBM50440063 CHEMBL2426077

SMILES: OC(=O)CCCC(=O)N1N=C(CC1c1ccc(Cl)cc1)c1c(-c2ccc(Cl)cc2)c2ccccc2[nH]c1=O

InChI Key: InChIKey=FIZNNLVOEMTONA-UHFFFAOYSA-N

Data: 4 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50440063   
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
Glutamate receptor ionotropic, NMDA 2D


(Rattus norvegicus (Rat))
BDBM50440063
PNG
(CHEMBL2426077)
Show SMILES OC(=O)CCCC(=O)N1N=C(CC1c1ccc(Cl)cc1)c1c(-c2ccc(Cl)cc2)c2ccccc2[nH]c1=O |c:9|
Show InChI InChI=1S/C29H23Cl2N3O4/c30-19-12-8-17(9-13-19)24-16-23(33-34(24)25(35)6-3-7-26(36)37)28-27(18-10-14-20(31)15-11-18)21-4-1-2-5-22(21)32-29(28)38/h1-2,4-5,8-15,24H,3,6-7,16H2,(H,32,38)(H,36,37)
PDB

UniProtKB/SwissProt

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PC sid
UniChem

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Article
PubMed
n/an/a 690n/an/an/an/an/an/a



Emory University

Curated by ChEMBL


Assay Description
Negative allosteric modulation of recombinant rat GluN2D receptor expressed in Xenopus laevis oocytes by two-electrode voltage clamp method


J Med Chem 56: 6434-56 (2013)


Article DOI: 10.1021/jm400652r
BindingDB Entry DOI: 10.7270/Q26H4JTJ
More data for this
Ligand-Target Pair
NMDA receptor subunit N2A (GluN2A)


(Rattus norvegicus (Rat))
BDBM50440063
PNG
(CHEMBL2426077)
Show SMILES OC(=O)CCCC(=O)N1N=C(CC1c1ccc(Cl)cc1)c1c(-c2ccc(Cl)cc2)c2ccccc2[nH]c1=O |c:9|
Show InChI InChI=1S/C29H23Cl2N3O4/c30-19-12-8-17(9-13-19)24-16-23(33-34(24)25(35)6-3-7-26(36)37)28-27(18-10-14-20(31)15-11-18)21-4-1-2-5-22(21)32-29(28)38/h1-2,4-5,8-15,24H,3,6-7,16H2,(H,32,38)(H,36,37)
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PC sid
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Article
PubMed
n/an/a 6.20E+4n/an/an/an/an/an/a



Emory University

Curated by ChEMBL


Assay Description
Negative allosteric modulation of recombinant rat GluN2A receptor expressed in Xenopus laevis oocytes by two-electrode voltage clamp method


J Med Chem 56: 6434-56 (2013)


Article DOI: 10.1021/jm400652r
BindingDB Entry DOI: 10.7270/Q26H4JTJ
More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 2B


(Rattus norvegicus (Rat))
BDBM50440063
PNG
(CHEMBL2426077)
Show SMILES OC(=O)CCCC(=O)N1N=C(CC1c1ccc(Cl)cc1)c1c(-c2ccc(Cl)cc2)c2ccccc2[nH]c1=O |c:9|
Show InChI InChI=1S/C29H23Cl2N3O4/c30-19-12-8-17(9-13-19)24-16-23(33-34(24)25(35)6-3-7-26(36)37)28-27(18-10-14-20(31)15-11-18)21-4-1-2-5-22(21)32-29(28)38/h1-2,4-5,8-15,24H,3,6-7,16H2,(H,32,38)(H,36,37)
PDB

UniProtKB/SwissProt

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PC sid
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Article
PubMed
n/an/a 3.30E+4n/an/an/an/an/an/a



Emory University

Curated by ChEMBL


Assay Description
Negative allosteric modulation of recombinant rat GluN2B receptor expressed in Xenopus laevis oocytes by two-electrode voltage clamp method


J Med Chem 56: 6434-56 (2013)


Article DOI: 10.1021/jm400652r
BindingDB Entry DOI: 10.7270/Q26H4JTJ
More data for this
Ligand-Target Pair
NMDA receptor subunit 2C (GluN2C)


(Rattus norvegicus (Rat))
BDBM50440063
PNG
(CHEMBL2426077)
Show SMILES OC(=O)CCCC(=O)N1N=C(CC1c1ccc(Cl)cc1)c1c(-c2ccc(Cl)cc2)c2ccccc2[nH]c1=O |c:9|
Show InChI InChI=1S/C29H23Cl2N3O4/c30-19-12-8-17(9-13-19)24-16-23(33-34(24)25(35)6-3-7-26(36)37)28-27(18-10-14-20(31)15-11-18)21-4-1-2-5-22(21)32-29(28)38/h1-2,4-5,8-15,24H,3,6-7,16H2,(H,32,38)(H,36,37)
UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

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



Emory University

Curated by ChEMBL


Assay Description
Negative allosteric modulation of recombinant rat GluN2C receptor expressed in Xenopus laevis oocytes by two-electrode voltage clamp method


J Med Chem 56: 6434-56 (2013)


Article DOI: 10.1021/jm400652r
BindingDB Entry DOI: 10.7270/Q26H4JTJ
More data for this
Ligand-Target Pair