BDBM311347 (S)-1-((3-(difluoromethyl)-5-(quinolin-4-yl)pyridin-2-yl)oxy)-2,4-dimethylpentan-2-amine::US10155760, Example 204::US10351563, Example 204::US10544120, Example 204::US10723734, Example 204::US10981910, Example 204::US9902722, Example 204

SMILES: CC(C)C[C@](C)(N)COc1ncc(cc1C(F)F)-c1ccnc2ccccc12

InChI Key: InChIKey=VZSXUICSTBAKTM-QFIPXVFZSA-N

Data: 7 IC50

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 7 hits for monomerid = 311347   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
AP2-associated protein kinase 1 (Homo sapiens (Human))	BDBM311347 ((S)-1-((3-(difluoromethyl)-5-(quinolin-4-yl)pyridi...) Show SMILES CC(C)C[C@](C)(N)COc1ncc(cc1C(F)F)-c1ccnc2ccccc12 |r| Show InChI InChI=1S/C22H25F2N3O/c1-14(2)11-22(3,25)13-28-21-18(20(23)24)10-15(12-27-21)16-8-9-26-19-7-5-4-6-17(16)19/h4-10,12,14,20H,11,13,25H2,1-3H3/t22-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.230	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...				US Patent US10155760 (2018) BindingDB Entry DOI: 10.7270/Q2F191S4
					More data for this Ligand-Target Pair
AP2-associated protein kinase 1 (Homo sapiens (Human))	BDBM311347 ((S)-1-((3-(difluoromethyl)-5-(quinolin-4-yl)pyridi...) Show SMILES CC(C)C[C@](C)(N)COc1ncc(cc1C(F)F)-c1ccnc2ccccc12 |r| Show InChI InChI=1S/C22H25F2N3O/c1-14(2)11-22(3,25)13-28-21-18(20(23)24)10-15(12-27-21)16-8-9-26-19-7-5-4-6-17(16)19/h4-10,12,14,20H,11,13,25H2,1-3H3/t22-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.230	n/a	n/a	n/a	n/a	n/a	n/a
University of Mississippi					Assay Description The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...				J Med Chem 48: 2906-15 (2005) BindingDB Entry DOI: 10.7270/Q2930WGG
					More data for this Ligand-Target Pair
AP2-associated protein kinase 1 (Homo sapiens (Human))	BDBM311347 ((S)-1-((3-(difluoromethyl)-5-(quinolin-4-yl)pyridi...) Show SMILES CC(C)C[C@](C)(N)COc1ncc(cc1C(F)F)-c1ccnc2ccccc12 |r| Show InChI InChI=1S/C22H25F2N3O/c1-14(2)11-22(3,25)13-28-21-18(20(23)24)10-15(12-27-21)16-8-9-26-19-7-5-4-6-17(16)19/h4-10,12,14,20H,11,13,25H2,1-3H3/t22-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.230	n/a	n/a	n/a	n/a	n/a	n/a
Therachem Research Medilab (India) Pvt. Ltd. Curated by ChEMBL					Assay Description Displacement of the 5-hydroxytryptamine 3 receptor ligand [3H]GR-65630 from rat brain cortical membranes.				ACS Med Chem Lett 8: 595-597 (2017) Article DOI: 10.1021/acsmedchemlett.7b00208 BindingDB Entry DOI: 10.7270/Q2PR7ZD1
					More data for this Ligand-Target Pair
AP2-associated protein kinase 1 (Homo sapiens (Human))	BDBM311347 ((S)-1-((3-(difluoromethyl)-5-(quinolin-4-yl)pyridi...) Show SMILES CC(C)C[C@](C)(N)COc1ncc(cc1C(F)F)-c1ccnc2ccccc12 |r| Show InChI InChI=1S/C22H25F2N3O/c1-14(2)11-22(3,25)13-28-21-18(20(23)24)10-15(12-27-21)16-8-9-26-19-7-5-4-6-17(16)19/h4-10,12,14,20H,11,13,25H2,1-3H3/t22-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.230	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...				US Patent US10981910 (2021)
					More data for this Ligand-Target Pair
AP2-associated protein kinase 1 (Homo sapiens (Human))	BDBM311347 ((S)-1-((3-(difluoromethyl)-5-(quinolin-4-yl)pyridi...) Show SMILES CC(C)C[C@](C)(N)COc1ncc(cc1C(F)F)-c1ccnc2ccccc12 |r| Show InChI InChI=1S/C22H25F2N3O/c1-14(2)11-22(3,25)13-28-21-18(20(23)24)10-15(12-27-21)16-8-9-26-19-7-5-4-6-17(16)19/h4-10,12,14,20H,11,13,25H2,1-3H3/t22-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.230	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...				US Patent US10544120 (2020) BindingDB Entry DOI: 10.7270/Q2RF5XCX
					More data for this Ligand-Target Pair
AP2-associated protein kinase 1 (Homo sapiens (Human))	BDBM311347 ((S)-1-((3-(difluoromethyl)-5-(quinolin-4-yl)pyridi...) Show SMILES CC(C)C[C@](C)(N)COc1ncc(cc1C(F)F)-c1ccnc2ccccc12 |r| Show InChI InChI=1S/C22H25F2N3O/c1-14(2)11-22(3,25)13-28-21-18(20(23)24)10-15(12-27-21)16-8-9-26-19-7-5-4-6-17(16)19/h4-10,12,14,20H,11,13,25H2,1-3H3/t22-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.230	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well plates. The final assay volume was 30 Cl prepared from 15 μl additions of enzyme and substrates (...				US Patent US10723734 (2020)
					More data for this Ligand-Target Pair
AP2-associated protein kinase 1 (Homo sapiens (Human))	BDBM311347 ((S)-1-((3-(difluoromethyl)-5-(quinolin-4-yl)pyridi...) Show SMILES CC(C)C[C@](C)(N)COc1ncc(cc1C(F)F)-c1ccnc2ccccc12 |r| Show InChI InChI=1S/C22H25F2N3O/c1-14(2)11-22(3,25)13-28-21-18(20(23)24)10-15(12-27-21)16-8-9-26-19-7-5-4-6-17(16)19/h4-10,12,14,20H,11,13,25H2,1-3H3/t22-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.230	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Co. US Patent					Assay Description The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...				US Patent US10351563 (2019) BindingDB Entry DOI: 10.7270/Q2P55QWS
					More data for this Ligand-Target Pair