BDBM267790 4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-3-yl)carbonyl]piperidin-3-yl}imidazo[1,5-a]pyrazin-1-yl)-3-fluoro-N-[4-(trifluoromethyl)pyridin-2-yl]benzamide::US9718828, Example, 396

SMILES C[C@H]1CC[C@H](CN1C(=O)C1CC1)c1nc(-c2ccc(cc2F)C(=O)Nc2cc(ccn2)C(F)(F)F)c2c(N)nccn12

InChI Key InChIKey=JUSWPUDQOKINJO-MAUKXSAKSA-N

Data  28 IC50

PDB links: 1 PDB ID matches this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 28 hits for monomerid = 267790   

TargetTyrosine-protein kinase BTK(Human)
Merck Sharp & Dohme

US Patent

LigandBDBM267790(4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-...)Copy SMILESCopy InChI

Affinity DataIC50: <10nMAssay Description:BTK enzymatic activity was determined with the LANCE (Lanthanide Chelate Excite) TR-FRET (Time-resolved fluorescence resonance energy transfer) assay...More data for this Ligand-Target Pair

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TargetTyrosine-protein kinase BTK(Human)
Merck Sharp & Dohme

US Patent

LigandBDBM267790(4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-...)Copy SMILESCopy InChI

Affinity DataIC50:  94nMAssay Description:Inhibition of BTK in human whole blood assessed as reduction in cell surface CD69 expression preincubated for 1 hr followed by stimulation with anti-...More data for this Ligand-Target Pair

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TargetTyrosine-protein kinase BTK(Human)
Merck Sharp & Dohme

US Patent

LigandBDBM267790(4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-...)Copy SMILESCopy InChI

Affinity DataIC50:  0.300nMAssay Description:Inhibition of 6-His-tagged recombinant full length BTK (unknown origin) expressed in baculovirus-transfected Sf9 cells using Biotin-EQEDEPEGDYFEWLE-N...More data for this Ligand-Target Pair

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TargetTyrosine-protein kinase BTK(Human)
Merck Sharp & Dohme

US Patent

LigandBDBM267790(4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-...)Copy SMILESCopy InChI

Affinity DataIC50:  4nMAssay Description:Inhibition of BTK in human PBMCMore data for this Ligand-Target Pair

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TargetSodium channel protein type 5 subunit alpha(Human)
Merck

Curated by ChEMBL

LigandBDBM267790(4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-...)Copy SMILESCopy InChI

Affinity DataIC50: >3.00E+4nMAssay Description:Inhibition of Nav1.5 (unknown origin)More data for this Ligand-Target Pair

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TargetVoltage-dependent L-type calcium channel subunit alpha-1C(Human)
Merck

Curated by ChEMBL

LigandBDBM267790(4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-...)Copy SMILESCopy InChI

Affinity DataIC50:  4.50E+3nMAssay Description:Inhibition of Cav1.2 (unknown origin)More data for this Ligand-Target Pair

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TargetTyrosine-protein kinase BTK(Human)
Merck Sharp & Dohme

US Patent

LigandBDBM267790(4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-...)Copy SMILESCopy InChI

Affinity DataIC50:  0.310nMAssay Description:Reversible inhibition of recombinant full length BTK (unknown origin) baculovirus infected Sf9 cells using biotinylated EQEDEPEGDYFEWLE-NH2 peptide a...More data for this Ligand-Target Pair

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TargetTyrosine-protein kinase BTK(Human)
Merck Sharp & Dohme

US Patent

LigandBDBM267790(4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-...)Copy SMILESCopy InChI

Affinity DataIC50:  4nMAssay Description:Inhibition of BTK in human PBMC assessed as reduction in cell surface CD69 expression preincubated for 1 hr followed by stimulation with goat anti-hu...More data for this Ligand-Target Pair

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TargetTyrosine-protein kinase BTK(Human)
Merck Sharp & Dohme

US Patent

LigandBDBM267790(4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-...)Copy SMILESCopy InChI

Affinity DataIC50:  94nMAssay Description:Inhibition of BTK in human whole blood assessed as reduction in cell surface CD69 expression preincubated for 1 hr followed by stimulation with anti-...More data for this Ligand-Target Pair

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TargetTyrosine-protein kinase Blk(Human)
Merck Research Laboratories

Curated by ChEMBL

LigandBDBM267790(4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-...)Copy SMILESCopy InChI

Affinity DataIC50:  20nMAssay Description:Inhibition of human BLKMore data for this Ligand-Target Pair

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TargetCytoplasmic tyrosine-protein kinase BMX(Human)
Merck Research Laboratories

Curated by ChEMBL

LigandBDBM267790(4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-...)Copy SMILESCopy InChI

Affinity DataIC50:  11nMAssay Description:Inhibition of human BMXMore data for this Ligand-Target Pair

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TargetTyrosine-protein kinase CSK(Human)
Merck Research Laboratories

Curated by ChEMBL

LigandBDBM267790(4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-...)Copy SMILESCopy InChI

Affinity DataIC50:  201nMAssay Description:Inhibition of human CSKMore data for this Ligand-Target Pair

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TargetReceptor tyrosine-protein kinase erbB-4(Human)
Merck Research Laboratories

Curated by ChEMBL

LigandBDBM267790(4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-...)Copy SMILESCopy InChI

Affinity DataIC50:  65nMAssay Description:Inhibition of human ERBB4More data for this Ligand-Target Pair

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TargetTyrosine-protein kinase Fgr(Human)
Merck Research Laboratories

Curated by ChEMBL

LigandBDBM267790(4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-...)Copy SMILESCopy InChI

Affinity DataIC50:  37nMAssay Description:Inhibition of human FGRMore data for this Ligand-Target Pair

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TargetTyrosine-protein kinase FRK(Human)
Merck Research Laboratories

Curated by ChEMBL

LigandBDBM267790(4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-...)Copy SMILESCopy InChI

Affinity DataIC50:  111nMAssay Description:Inhibition of human FRKMore data for this Ligand-Target Pair

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TargetTyrosine-protein kinase Fyn(Human)
Merck Research Laboratories

Curated by ChEMBL

LigandBDBM267790(4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-...)Copy SMILESCopy InChI

Affinity DataIC50:  198nMAssay Description:Inhibition of human FYNMore data for this Ligand-Target Pair

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TargetTyrosine-protein kinase ITK/TSK(Human)
Merck Research Laboratories

Curated by ChEMBL

LigandBDBM267790(4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-...)Copy SMILESCopy InChI

Affinity DataIC50:  1.20E+3nMAssay Description:Inhibition of human ITKMore data for this Ligand-Target Pair

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TargetTyrosine-protein kinase Lck(Human)
Merck Research Laboratories

Curated by ChEMBL

LigandBDBM267790(4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-...)Copy SMILESCopy InChI

Affinity DataIC50:  12nMAssay Description:Inhibition of human LCKMore data for this Ligand-Target Pair

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TargetTyrosine-protein kinase Lyn(Human)
Merck Research Laboratories

Curated by ChEMBL

LigandBDBM267790(4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-...)Copy SMILESCopy InChI

Affinity DataIC50:  131nMAssay Description:Inhibition of human LYNBMore data for this Ligand-Target Pair

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TargetProtein-tyrosine kinase 6(Human)
Merck Research Laboratories

Curated by ChEMBL

LigandBDBM267790(4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-...)Copy SMILESCopy InChI

Affinity DataIC50:  60nMAssay Description:Inhibition of human PTK6More data for this Ligand-Target Pair

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TargetProto-oncogene tyrosine-protein kinase Src(Human)
Merck Research Laboratories

Curated by ChEMBL

LigandBDBM267790(4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-...)Copy SMILESCopy InChI

Affinity DataIC50:  89nMAssay Description:Inhibition of human SRCMore data for this Ligand-Target Pair

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TargetTyrosine-protein kinase Srms(Human)
Merck Research Laboratories

Curated by ChEMBL

LigandBDBM267790(4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-...)Copy SMILESCopy InChI

Affinity DataIC50:  23nMAssay Description:Inhibition of human SRMSMore data for this Ligand-Target Pair

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TargetTyrosine-protein kinase Tec(Human)
Merck Research Laboratories

Curated by ChEMBL

LigandBDBM267790(4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-...)Copy SMILESCopy InChI

Affinity DataIC50:  63nMAssay Description:Inhibition of human TECMore data for this Ligand-Target Pair

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TargetTyrosine-protein kinase TXK(Human)
Merck Research Laboratories

Curated by ChEMBL

LigandBDBM267790(4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-...)Copy SMILESCopy InChI

Affinity DataIC50:  33nMAssay Description:Inhibition of human TXKMore data for this Ligand-Target Pair

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TargetTyrosine-protein kinase Yes(Human)
Merck Research Laboratories

Curated by ChEMBL

LigandBDBM267790(4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-...)Copy SMILESCopy InChI

Affinity DataIC50:  21nMAssay Description:Inhibition of human YES1More data for this Ligand-Target Pair

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TargetTyrosine-protein kinase BTK(Human)
Merck Sharp & Dohme

US Patent

LigandBDBM267790(4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-...)Copy SMILESCopy InChI

Affinity DataIC50:  0.310nMAssay Description:Inhibition of recombinant full length BTK (unknown origin) expressed in baculovirus infected Sf9 cells using Biotin-EQEDEPEGDYFEWLE-NH2 peptide as su...More data for this Ligand-Target Pair

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TargetTyrosine-protein kinase BTK(Human)
Merck Sharp & Dohme

US Patent

LigandBDBM267790(4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-...)Copy SMILESCopy InChI

Affinity DataIC50:  4nMAssay Description:Inhibition of BTK in human PBMC assessed as reduction in cell surface CD69 expression preincubated for 1 hr followed by stimulation with goat anti-hu...More data for this Ligand-Target Pair

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TargetPotassium voltage-gated channel subfamily H member 2(Human)
Merck

Curated by ChEMBL

LigandBDBM267790(4-(8-amino-3-{(3R,6S)-6-methyl-1-[(3-methyloxetan-...)Copy SMILESCopy InChI

Affinity DataIC50:  4.30E+3nMAssay Description:Inhibition of human ERGMore data for this Ligand-Target Pair

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