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2 similar compounds to monomer 97162

Compile data set for download or QSAR
Wt: 303.3
BDBM81449
Wt: 299.4
BDBM50066545
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 81449,50066545   
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
Beta-2 adrenergic receptor and beta-3 adrenergic receptor


(Homo sapiens (Human))
BDBM81449
PNG
(CAS_193350 | Cc-25,(+/-) | NSC_193350)
Show SMILES CC(Cc1ccc(O)cc1)NCC(O)c1ccc(O)c(O)c1
Show InChI InChI=1S/C17H21NO4/c1-11(8-12-2-5-14(19)6-3-12)18-10-17(22)13-4-7-15(20)16(21)9-13/h2-7,9,11,17-22H,8,10H2,1H3
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PubMed
180n/an/an/an/an/an/an/an/a



TBA

Curated by PDSP Ki Database




Mol Pharmacol 12: 568-80 (1976)


BindingDB Entry DOI: 10.7270/Q2ZK5F5P
More data for this
Ligand-Target Pair
Glutamate [NMDA] receptor subunit epsilon 2/zeta 1


(Rattus norvegicus (Rat)-RAT)
BDBM50066545
PNG
(4-[(1S,2R)-1-Hydroxy-2-((R)-1-methyl-3-phenyl-prop...)
Show SMILES C[C@H](CCc1ccccc1)N[C@H](C)[C@@H](O)c1ccc(O)cc1
Show InChI InChI=1S/C19H25NO2/c1-14(8-9-16-6-4-3-5-7-16)20-15(2)19(22)17-10-12-18(21)13-11-17/h3-7,10-15,19-22H,8-9H2,1-2H3/t14-,15-,19-/m1/s1
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CHEMBL
PC cid
PC sid
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Article
PubMed
n/an/a 180n/an/an/an/an/an/a



University of Oregon

Curated by ChEMBL


Assay Description
Functional antagonism by electrical assays in Xenopus oocytes expressing the 1A/2B NMDA receptor


J Med Chem 41: 3499-506 (1998)


Article DOI: 10.1021/jm980235+
BindingDB Entry DOI: 10.7270/Q29Z95MM
More data for this
Ligand-Target Pair
Glutamate [NMDA] receptor subunit epsilon 1/zeta 1


(Rattus norvegicus (Rat)-RAT)
BDBM50066545
PNG
(4-[(1S,2R)-1-Hydroxy-2-((R)-1-methyl-3-phenyl-prop...)
Show SMILES C[C@H](CCc1ccccc1)N[C@H](C)[C@@H](O)c1ccc(O)cc1
Show InChI InChI=1S/C19H25NO2/c1-14(8-9-16-6-4-3-5-7-16)20-15(2)19(22)17-10-12-18(21)13-11-17/h3-7,10-15,19-22H,8-9H2,1-2H3/t14-,15-,19-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
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CHEMBL
PC cid
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Article
PubMed
n/an/a 3.20E+4n/an/an/an/an/an/a



University of Oregon

Curated by ChEMBL


Assay Description
Functional antagonism by electrical assays in Xenopus oocytes expressing 1A/2A NMDA receptor subtype


J Med Chem 41: 3499-506 (1998)


Article DOI: 10.1021/jm980235+
BindingDB Entry DOI: 10.7270/Q29Z95MM
More data for this
Ligand-Target Pair
Glutamate [NMDA] receptor subunit epsilon 3/zeta 1


(RAT-Rattus norvegicus (Rat))
BDBM50066545
PNG
(4-[(1S,2R)-1-Hydroxy-2-((R)-1-methyl-3-phenyl-prop...)
Show SMILES C[C@H](CCc1ccccc1)N[C@H](C)[C@@H](O)c1ccc(O)cc1
Show InChI InChI=1S/C19H25NO2/c1-14(8-9-16-6-4-3-5-7-16)20-15(2)19(22)17-10-12-18(21)13-11-17/h3-7,10-15,19-22H,8-9H2,1-2H3/t14-,15-,19-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4.20E+4n/an/an/an/an/an/a



University of Oregon

Curated by ChEMBL


Assay Description
Functional antagonism by electrical assays in Xenopus oocytes expressing the 1A/2C NMDA receptor


J Med Chem 41: 3499-506 (1998)


Article DOI: 10.1021/jm980235+
BindingDB Entry DOI: 10.7270/Q29Z95MM
More data for this
Ligand-Target Pair