null

SMILES COC[C@@H](C)N[C@H]1CC[C@@H](CC1)Nc1cc(c(Cl)cn1)-c1cccc(NCC2(CCOCC2)C#N)n1

InChI Key InChIKey=XWQVQSXLXAXOPJ-NJDAHSKKSA-N

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 17 hits for monomerid = 126500   

TargetCyclin-T1(Homo sapiens (Human))
Novartis AG

US Patent
LigandPNGBDBM126500(US11591322, Compound NVP-2 | US8778951, 310)copy SMILEScopy InChI
Affinity DataIC50: 0.000300nMAssay Description:Cdk9/cyclinT1 is purchased from Millipore, cat #14-685. The final total protein concentration in the assay 4 nM. The 5TAMRA-cdk7tide peptide substrat...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q25B014TUS Patent
LigandPNGBDBM126500(US11591322, Compound NVP-2 | US8778951, 310)copy SMILEScopy InChI
Affinity DataIC50: 350nMAssay Description:Effective concentration required for inhibitory activity towards human beta-1 adrenergic receptorMore data for this Ligand-Target Pair
In DepthDetails
TargetCyclin-K(Homo sapiens (Human))
Anhui Medical University

Curated by ChEMBL
LigandPNGBDBM126500(US11591322, Compound NVP-2 | US8778951, 310)copy SMILEScopy InChI
Affinity DataIC50: 2nMAssay Description:Inhibition of recombinant human full-length N-terminal GST-tagged CDK9/cyclinK expressed in baculovirus infected Sf9 insect cells using PDKtide as su...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2N87F9BPubMed
TargetCyclin-A2/Cyclin-dependent kinase 2(Homo sapiens (Human))
Anhui Medical University

Curated by ChEMBL
LigandPNGBDBM126500(US11591322, Compound NVP-2 | US8778951, 310)copy SMILEScopy InChI
Affinity DataIC50: 3.46E+3nMAssay Description:Inhibition of recombinant human full-length N-terminal GST-tagged CDK2/cyclinA2 expressed in baculovirus infected Sf9 insect cells using histone H1 a...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2N87F9BPubMed
TargetCyclin-dependent kinase 9(Homo sapiens (Human))TBA
LigandPNGBDBM126500(US11591322, Compound NVP-2 | US8778951, 310)copy SMILEScopy InChI
Affinity DataIC50: 0.5nMMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2BV7MPDPubMed
TargetCyclin-T1/Cyclin-dependent kinase 9(Homo sapiens (Human))TBA
LigandPNGBDBM126500(US11591322, Compound NVP-2 | US8778951, 310)copy SMILEScopy InChI
Affinity DataIC50: 3.75nMAssay Description:To each well of a 96-well plate was added 5× kinase assay buffer with 10 mM DTT (6 μL), 500 μM ATP (1 μL), 5×CDK substrate (10 μL...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q2DB85S6US Patent
TargetCyclin-dependent kinase 9(Homo sapiens (Human))TBA
LigandPNGBDBM126500(US11591322, Compound NVP-2 | US8778951, 310)copy SMILEScopy InChI
Affinity DataIC50: 0.514nMAssay Description:Effective concentration required for inhibitory activity towards human beta-1 adrenergic receptorMore data for this Ligand-Target Pair
In DepthDetails
TargetCyclin-dependent kinase 1(Homo sapiens (Human))TBA
LigandPNGBDBM126500(US11591322, Compound NVP-2 | US8778951, 310)copy SMILEScopy InChI
Affinity DataIC50: 584nMAssay Description:Effective concentration required for inhibitory activity towards human beta-1 adrenergic receptorMore data for this Ligand-Target Pair
In DepthDetails
TargetCyclin-dependent kinase 2(Homo sapiens (Human))TBA
LigandPNGBDBM126500(US11591322, Compound NVP-2 | US8778951, 310)copy SMILEScopy InChI
Affinity DataIC50: 706nMAssay Description:Effective concentration required for inhibitory activity towards human beta-1 adrenergic receptorMore data for this Ligand-Target Pair
In DepthDetails
TargetCyclin-dependent kinase 5(Homo sapiens (Human))TBA
LigandPNGBDBM126500(US11591322, Compound NVP-2 | US8778951, 310)copy SMILEScopy InChI
Affinity DataIC50: 1.05E+3nMAssay Description:Effective concentration required for inhibitory activity towards human beta-1 adrenergic receptorMore data for this Ligand-Target Pair
In DepthDetails
TargetCyclin-dependent kinase 7(Homo sapiens (Human))TBA
LigandPNGBDBM126500(US11591322, Compound NVP-2 | US8778951, 310)copy SMILEScopy InChI
Affinity DataIC50: 1.00E+4nMAssay Description:Effective concentration required for inhibitory activity towards human beta-1 adrenergic receptorMore data for this Ligand-Target Pair
In DepthDetails
TargetCyclin-dependent kinase 8(Homo sapiens (Human))TBA
LigandPNGBDBM126500(US11591322, Compound NVP-2 | US8778951, 310)copy SMILEScopy InChI
Affinity DataIC50: 1.00E+4nMAssay Description:Effective concentration required for inhibitory activity towards human beta-1 adrenergic receptorMore data for this Ligand-Target Pair
In DepthDetails
TargetCyclin-dependent kinase 14(Homo sapiens (Human))TBA
LigandPNGBDBM126500(US11591322, Compound NVP-2 | US8778951, 310)copy SMILEScopy InChI
Affinity DataIC50: 3.45E+3nMAssay Description:Effective concentration required for inhibitory activity towards human beta-1 adrenergic receptorMore data for this Ligand-Target Pair
In DepthDetails
TargetCyclin-dependent kinase 16(Homo sapiens (Human))TBA
LigandPNGBDBM126500(US11591322, Compound NVP-2 | US8778951, 310)copy SMILEScopy InChI
Affinity DataIC50: 605nMAssay Description:Effective concentration required for inhibitory activity towards human beta-1 adrenergic receptorMore data for this Ligand-Target Pair
In DepthDetails
TargetCyclin-dependent kinase 17(Homo sapiens (Human))TBA
LigandPNGBDBM126500(US11591322, Compound NVP-2 | US8778951, 310)copy SMILEScopy InChI
Affinity DataIC50: 1.50E+3nMAssay Description:Effective concentration required for inhibitory activity towards human beta-1 adrenergic receptorMore data for this Ligand-Target Pair
In DepthDetails
TargetCyclin-dependent kinase 18(Homo sapiens)TBA
LigandPNGBDBM126500(US11591322, Compound NVP-2 | US8778951, 310)copy SMILEScopy InChI
Affinity DataIC50: 4.90E+3nMAssay Description:Effective concentration required for inhibitory activity towards human beta-1 adrenergic receptorMore data for this Ligand-Target Pair
In DepthDetails
TargetCyclin-dependent kinase 6/G1/S-specific cyclin-D3(Homo sapiens (Human))
Anhui Medical University

Curated by ChEMBL
LigandPNGBDBM126500(US11591322, Compound NVP-2 | US8778951, 310)copy SMILEScopy InChI
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of recombinant human full-length N-terminal His-tagged CDK6/cyclinD3 expressed in baculovirus infected Sf9 insect cells using histone H1 a...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2N87F9BPubMed