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SMILES: S=C(NCC12CC3CC(CC(C3)C1)C2)Nc1nccs1

InChI Key: InChIKey=YVDWMGNODCFVJL-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50097038   
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
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM50097038
PNG
(1-Adamantan-1-ylmethyl-3-thiazol-2-yl-thiourea | C...)
Show SMILES S=C(NCC12CC3CC(CC(C3)C1)C2)Nc1nccs1 |TLB:7:8:12:6.5.11,THB:7:6:12:8.13.9,9:8:5:10.12.11,9:10:5:8.13.7|
Show InChI InChI=1S/C15H21N3S2/c19-13(18-14-16-1-2-20-14)17-9-15-6-10-3-11(7-15)5-12(4-10)8-15/h1-2,10-12H,3-9H2,(H2,16,17,18,19)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 1.30E+3n/an/an/an/an/an/a



Institute

Curated by ChEMBL


Assay Description
Compound was tested for agonistic activity against 5-HT uptake


Bioorg Med Chem Lett 11: 523-8 (2001)


BindingDB Entry DOI: 10.7270/Q237780X
More data for this
Ligand-Target Pair
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM50097038
PNG
(1-Adamantan-1-ylmethyl-3-thiazol-2-yl-thiourea | C...)
Show SMILES S=C(NCC12CC3CC(CC(C3)C1)C2)Nc1nccs1 |TLB:7:8:12:6.5.11,THB:7:6:12:8.13.9,9:8:5:10.12.11,9:10:5:8.13.7|
Show InChI InChI=1S/C15H21N3S2/c19-13(18-14-16-1-2-20-14)17-9-15-6-10-3-11(7-15)5-12(4-10)8-15/h1-2,10-12H,3-9H2,(H2,16,17,18,19)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 600n/an/an/an/an/an/a



Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against non-nucleoside reverse transcriptase inhibitors (NNRTI) -resistant HIV-1 strain A17 with a Y181C mutation in RT (reverse ...


Bioorg Med Chem Lett 11: 523-8 (2001)


BindingDB Entry DOI: 10.7270/Q237780X
More data for this
Ligand-Target Pair