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BDBM39537 MLS000077996::N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-2-furamide::N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-2-furancarboxamide::N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]furan-2-carboxamide::SMR000018313::cid_663488

SMILES: [H]C12CC3([H])CC([H])(C1)CC(C2)(C3)c1nnc(NC(=O)c2ccco2)s1

InChI Key: InChIKey=SLCBTBPNDJWWLW-UHFFFAOYSA-N

Data: 2 EC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 39537   
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
Nuclear receptor ROR-alpha (Alpha-2)


(Homo sapiens (Human))
BDBM39537
PNG
(MLS000077996 | N-[5-(1-adamantyl)-1,3,4-thiadiazol...)
Show SMILES [H]C12CC3([H])CC([H])(C1)CC(C2)(C3)c1nnc(NC(=O)c2ccco2)s1 |TLB:5:3:11:6.9.8,THB:2:3:9:1.11.8,2:1:9:3.12.5,5:6:11:3.12.2|
Show InChI InChI=1S/C17H19N3O2S/c21-14(13-2-1-3-22-13)18-16-20-19-15(23-16)17-7-10-4-11(8-17)6-12(5-10)9-17/h1-3,10-12H,4-9H2,(H,18,20,21)
PDB
MMDB

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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 317n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2RJ4GVG
More data for this
Ligand-Target Pair
Steroidogenic factor 1


(Homo sapiens (Human))
BDBM39537
PNG
(MLS000077996 | N-[5-(1-adamantyl)-1,3,4-thiadiazol...)
Show SMILES [H]C12CC3([H])CC([H])(C1)CC(C2)(C3)c1nnc(NC(=O)c2ccco2)s1 |TLB:5:3:11:6.9.8,THB:2:3:9:1.11.8,2:1:9:3.12.5,5:6:11:3.12.2|
Show InChI InChI=1S/C17H19N3O2S/c21-14(13-2-1-3-22-13)18-16-20-19-15(23-16)17-7-10-4-11(8-17)6-12(5-10)9-17/h1-3,10-12H,4-9H2,(H,18,20,21)
PDB
MMDB

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UniProtKB/SwissProt
UniProtKB/TrEMBL

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DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 257n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2028PXQ
More data for this
Ligand-Target Pair