BDBM280349 (S)-4-(2-(5-chloro-2-fluorophenyl)-5-(dimethylamino)pyridin-4-ylamino)-N-(2-hydroxypropyl)nicotinamide::US10030004, Compound 16a::US10501436, Compound 16a

SMILES: C[C@H](O)CNC(=O)c1cnccc1Nc1cc(ncc1N(C)C)-c1cc(Cl)ccc1F

InChI Key: InChIKey=SRVVCPDKVNJPAH-ZDUSSCGKSA-N

Data: 12 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 18 hits for monomerid = 280349   

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
Serine/threonine-protein kinase receptor R3 (Homo sapiens (Human))	BDBM280349 ((S)-4-(2-(5-chloro-2-fluorophenyl)-5-(dimethylamin...) Show SMILES C[C@H](O)CNC(=O)c1cnccc1Nc1cc(ncc1N(C)C)-c1cc(Cl)ccc1F |r| Show InChI InChI=1S/C22H23ClFN5O2/c1-13(30)10-27-22(31)16-11-25-7-6-18(16)28-20-9-19(26-12-21(20)29(2)3)15-8-14(23)4-5-17(15)24/h4-9,11-13,30H,10H2,1-3H3,(H,27,31)(H,25,26,28)/t13-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	7.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Medivation Technologies LLC US Patent					Assay Description Compound of the invention were screened in an in vitro kinase assay against several members of the TGFβ family of Ser/Thr kinases. The kinases t...				US Patent US10030004 (2018) BindingDB Entry DOI: 10.7270/Q2QC05HQ
					More data for this Ligand-Target Pair
Bone morphogenetic protein 10 (Homo sapiens (Human))	BDBM280349 ((S)-4-(2-(5-chloro-2-fluorophenyl)-5-(dimethylamin...) Show SMILES C[C@H](O)CNC(=O)c1cnccc1Nc1cc(ncc1N(C)C)-c1cc(Cl)ccc1F |r| Show InChI InChI=1S/C22H23ClFN5O2/c1-13(30)10-27-22(31)16-11-25-7-6-18(16)28-20-9-19(26-12-21(20)29(2)3)15-8-14(23)4-5-17(15)24/h4-9,11-13,30H,10H2,1-3H3,(H,27,31)(H,25,26,28)/t13-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Activin receptor-like kinase 3 (ALK-3) (Homo sapiens (Human))	BDBM280349 ((S)-4-(2-(5-chloro-2-fluorophenyl)-5-(dimethylamin...) Show SMILES C[C@H](O)CNC(=O)c1cnccc1Nc1cc(ncc1N(C)C)-c1cc(Cl)ccc1F |r| Show InChI InChI=1S/C22H23ClFN5O2/c1-13(30)10-27-22(31)16-11-25-7-6-18(16)28-20-9-19(26-12-21(20)29(2)3)15-8-14(23)4-5-17(15)24/h4-9,11-13,30H,10H2,1-3H3,(H,27,31)(H,25,26,28)/t13-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
Medivation Technologies LLC US Patent					Assay Description Compound of the invention were screened in an in vitro kinase assay against several members of the TGFβ family of Ser/Thr kinases. The kinases t...				US Patent US10030004 (2018) BindingDB Entry DOI: 10.7270/Q2QC05HQ
					More data for this Ligand-Target Pair
Activin receptor type-1B (Homo sapiens (Human))	BDBM280349 ((S)-4-(2-(5-chloro-2-fluorophenyl)-5-(dimethylamin...) Show SMILES C[C@H](O)CNC(=O)c1cnccc1Nc1cc(ncc1N(C)C)-c1cc(Cl)ccc1F |r| Show InChI InChI=1S/C22H23ClFN5O2/c1-13(30)10-27-22(31)16-11-25-7-6-18(16)28-20-9-19(26-12-21(20)29(2)3)15-8-14(23)4-5-17(15)24/h4-9,11-13,30H,10H2,1-3H3,(H,27,31)(H,25,26,28)/t13-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	114	n/a	n/a	n/a	n/a	n/a	n/a
Medivation Technologies LLC US Patent					Assay Description Compound of the invention were screened in an in vitro kinase assay against several members of the TGFβ family of Ser/Thr kinases. The kinases t...				US Patent US10030004 (2018) BindingDB Entry DOI: 10.7270/Q2QC05HQ
					More data for this Ligand-Target Pair
TGF-beta receptor type-1 (Homo sapiens (Human))	BDBM280349 ((S)-4-(2-(5-chloro-2-fluorophenyl)-5-(dimethylamin...) Show SMILES C[C@H](O)CNC(=O)c1cnccc1Nc1cc(ncc1N(C)C)-c1cc(Cl)ccc1F |r| Show InChI InChI=1S/C22H23ClFN5O2/c1-13(30)10-27-22(31)16-11-25-7-6-18(16)28-20-9-19(26-12-21(20)29(2)3)15-8-14(23)4-5-17(15)24/h4-9,11-13,30H,10H2,1-3H3,(H,27,31)(H,25,26,28)/t13-/m0/s1	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	42.2	n/a	n/a	n/a	n/a	n/a	n/a
Medivation Technologies LLC US Patent					Assay Description Compound of the invention were screened in an in vitro kinase assay against several members of the TGFβ family of Ser/Thr kinases. The kinases t...				US Patent US10030004 (2018) BindingDB Entry DOI: 10.7270/Q2QC05HQ
					More data for this Ligand-Target Pair
Bone morphogenetic protein receptor type-1B (Mus musculus (Mouse))	BDBM280349 ((S)-4-(2-(5-chloro-2-fluorophenyl)-5-(dimethylamin...) Show SMILES C[C@H](O)CNC(=O)c1cnccc1Nc1cc(ncc1N(C)C)-c1cc(Cl)ccc1F |r| Show InChI InChI=1S/C22H23ClFN5O2/c1-13(30)10-27-22(31)16-11-25-7-6-18(16)28-20-9-19(26-12-21(20)29(2)3)15-8-14(23)4-5-17(15)24/h4-9,11-13,30H,10H2,1-3H3,(H,27,31)(H,25,26,28)/t13-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
Medivation Technologies LLC US Patent					Assay Description Compound of the invention were screened in an in vitro kinase assay against several members of the TGFβ family of Ser/Thr kinases. The kinases t...				US Patent US10030004 (2018) BindingDB Entry DOI: 10.7270/Q2QC05HQ
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase receptor R3 (Homo sapiens (Human))	BDBM280349 ((S)-4-(2-(5-chloro-2-fluorophenyl)-5-(dimethylamin...) Show SMILES C[C@H](O)CNC(=O)c1cnccc1Nc1cc(ncc1N(C)C)-c1cc(Cl)ccc1F |r| Show InChI InChI=1S/C22H23ClFN5O2/c1-13(30)10-27-22(31)16-11-25-7-6-18(16)28-20-9-19(26-12-21(20)29(2)3)15-8-14(23)4-5-17(15)24/h4-9,11-13,30H,10H2,1-3H3,(H,27,31)(H,25,26,28)/t13-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	7.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Medivation Technologies LLC US Patent					Assay Description Compound of the invention were screened in an in vitro kinase assay against several members of the TGFβ family of Ser/Thr kinases. The kinases t...				US Patent US10501436 (2019) BindingDB Entry DOI: 10.7270/Q20867PH
					More data for this Ligand-Target Pair
Activin receptor type-1 (Homo sapiens (Human))	BDBM280349 ((S)-4-(2-(5-chloro-2-fluorophenyl)-5-(dimethylamin...) Show SMILES C[C@H](O)CNC(=O)c1cnccc1Nc1cc(ncc1N(C)C)-c1cc(Cl)ccc1F |r| Show InChI InChI=1S/C22H23ClFN5O2/c1-13(30)10-27-22(31)16-11-25-7-6-18(16)28-20-9-19(26-12-21(20)29(2)3)15-8-14(23)4-5-17(15)24/h4-9,11-13,30H,10H2,1-3H3,(H,27,31)(H,25,26,28)/t13-/m0/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
Medivation Technologies LLC US Patent					Assay Description Compound of the invention were screened in an in vitro kinase assay against several members of the TGFβ family of Ser/Thr kinases. The kinases t...				US Patent US10501436 (2019) BindingDB Entry DOI: 10.7270/Q20867PH
					More data for this Ligand-Target Pair
Activin receptor-like kinase 3 (ALK-3) (Homo sapiens (Human))	BDBM280349 ((S)-4-(2-(5-chloro-2-fluorophenyl)-5-(dimethylamin...) Show SMILES C[C@H](O)CNC(=O)c1cnccc1Nc1cc(ncc1N(C)C)-c1cc(Cl)ccc1F |r| Show InChI InChI=1S/C22H23ClFN5O2/c1-13(30)10-27-22(31)16-11-25-7-6-18(16)28-20-9-19(26-12-21(20)29(2)3)15-8-14(23)4-5-17(15)24/h4-9,11-13,30H,10H2,1-3H3,(H,27,31)(H,25,26,28)/t13-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
Medivation Technologies LLC US Patent					Assay Description Compound of the invention were screened in an in vitro kinase assay against several members of the TGFβ family of Ser/Thr kinases. The kinases t...				US Patent US10501436 (2019) BindingDB Entry DOI: 10.7270/Q20867PH
					More data for this Ligand-Target Pair
Activin receptor type-1B (Homo sapiens (Human))	BDBM280349 ((S)-4-(2-(5-chloro-2-fluorophenyl)-5-(dimethylamin...) Show SMILES C[C@H](O)CNC(=O)c1cnccc1Nc1cc(ncc1N(C)C)-c1cc(Cl)ccc1F |r| Show InChI InChI=1S/C22H23ClFN5O2/c1-13(30)10-27-22(31)16-11-25-7-6-18(16)28-20-9-19(26-12-21(20)29(2)3)15-8-14(23)4-5-17(15)24/h4-9,11-13,30H,10H2,1-3H3,(H,27,31)(H,25,26,28)/t13-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	114	n/a	n/a	n/a	n/a	n/a	n/a
Medivation Technologies LLC US Patent					Assay Description Compound of the invention were screened in an in vitro kinase assay against several members of the TGFβ family of Ser/Thr kinases. The kinases t...				US Patent US10501436 (2019) BindingDB Entry DOI: 10.7270/Q20867PH
					More data for this Ligand-Target Pair
TGF-beta receptor type-1 (Homo sapiens (Human))	BDBM280349 ((S)-4-(2-(5-chloro-2-fluorophenyl)-5-(dimethylamin...) Show SMILES C[C@H](O)CNC(=O)c1cnccc1Nc1cc(ncc1N(C)C)-c1cc(Cl)ccc1F |r| Show InChI InChI=1S/C22H23ClFN5O2/c1-13(30)10-27-22(31)16-11-25-7-6-18(16)28-20-9-19(26-12-21(20)29(2)3)15-8-14(23)4-5-17(15)24/h4-9,11-13,30H,10H2,1-3H3,(H,27,31)(H,25,26,28)/t13-/m0/s1	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	42.2	n/a	n/a	n/a	n/a	n/a	n/a
Medivation Technologies LLC US Patent					Assay Description Compound of the invention were screened in an in vitro kinase assay against several members of the TGFβ family of Ser/Thr kinases. The kinases t...				US Patent US10501436 (2019) BindingDB Entry DOI: 10.7270/Q20867PH
					More data for this Ligand-Target Pair
Bone morphogenetic protein receptor type-1B (Homo sapiens (Human))	BDBM280349 ((S)-4-(2-(5-chloro-2-fluorophenyl)-5-(dimethylamin...) Show SMILES C[C@H](O)CNC(=O)c1cnccc1Nc1cc(ncc1N(C)C)-c1cc(Cl)ccc1F |r| Show InChI InChI=1S/C22H23ClFN5O2/c1-13(30)10-27-22(31)16-11-25-7-6-18(16)28-20-9-19(26-12-21(20)29(2)3)15-8-14(23)4-5-17(15)24/h4-9,11-13,30H,10H2,1-3H3,(H,27,31)(H,25,26,28)/t13-/m0/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
Medivation Technologies LLC US Patent					Assay Description Compound of the invention were screened in an in vitro kinase assay against several members of the TGFβ family of Ser/Thr kinases. The kinases t...				US Patent US10501436 (2019) BindingDB Entry DOI: 10.7270/Q20867PH
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase receptor R3 (Homo sapiens (Human))	BDBM280349 ((S)-4-(2-(5-chloro-2-fluorophenyl)-5-(dimethylamin...) Show SMILES C[C@H](O)CNC(=O)c1cnccc1Nc1cc(ncc1N(C)C)-c1cc(Cl)ccc1F |r| Show InChI InChI=1S/C22H23ClFN5O2/c1-13(30)10-27-22(31)16-11-25-7-6-18(16)28-20-9-19(26-12-21(20)29(2)3)15-8-14(23)4-5-17(15)24/h4-9,11-13,30H,10H2,1-3H3,(H,27,31)(H,25,26,28)/t13-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	7.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Activin receptor type-1 (Homo sapiens (Human))	BDBM280349 ((S)-4-(2-(5-chloro-2-fluorophenyl)-5-(dimethylamin...) Show SMILES C[C@H](O)CNC(=O)c1cnccc1Nc1cc(ncc1N(C)C)-c1cc(Cl)ccc1F |r| Show InChI InChI=1S/C22H23ClFN5O2/c1-13(30)10-27-22(31)16-11-25-7-6-18(16)28-20-9-19(26-12-21(20)29(2)3)15-8-14(23)4-5-17(15)24/h4-9,11-13,30H,10H2,1-3H3,(H,27,31)(H,25,26,28)/t13-/m0/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Activin receptor-like kinase 3 (ALK-3) (Homo sapiens (Human))	BDBM280349 ((S)-4-(2-(5-chloro-2-fluorophenyl)-5-(dimethylamin...) Show SMILES C[C@H](O)CNC(=O)c1cnccc1Nc1cc(ncc1N(C)C)-c1cc(Cl)ccc1F |r| Show InChI InChI=1S/C22H23ClFN5O2/c1-13(30)10-27-22(31)16-11-25-7-6-18(16)28-20-9-19(26-12-21(20)29(2)3)15-8-14(23)4-5-17(15)24/h4-9,11-13,30H,10H2,1-3H3,(H,27,31)(H,25,26,28)/t13-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Activin receptor type-1B (Homo sapiens (Human))	BDBM280349 ((S)-4-(2-(5-chloro-2-fluorophenyl)-5-(dimethylamin...) Show SMILES C[C@H](O)CNC(=O)c1cnccc1Nc1cc(ncc1N(C)C)-c1cc(Cl)ccc1F |r| Show InChI InChI=1S/C22H23ClFN5O2/c1-13(30)10-27-22(31)16-11-25-7-6-18(16)28-20-9-19(26-12-21(20)29(2)3)15-8-14(23)4-5-17(15)24/h4-9,11-13,30H,10H2,1-3H3,(H,27,31)(H,25,26,28)/t13-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	114	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
TGF-beta receptor type-1 (Homo sapiens (Human))	BDBM280349 ((S)-4-(2-(5-chloro-2-fluorophenyl)-5-(dimethylamin...) Show SMILES C[C@H](O)CNC(=O)c1cnccc1Nc1cc(ncc1N(C)C)-c1cc(Cl)ccc1F |r| Show InChI InChI=1S/C22H23ClFN5O2/c1-13(30)10-27-22(31)16-11-25-7-6-18(16)28-20-9-19(26-12-21(20)29(2)3)15-8-14(23)4-5-17(15)24/h4-9,11-13,30H,10H2,1-3H3,(H,27,31)(H,25,26,28)/t13-/m0/s1	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	42.2	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Activin receptor type-1 (Homo sapiens (Human))	BDBM280349 ((S)-4-(2-(5-chloro-2-fluorophenyl)-5-(dimethylamin...) Show SMILES C[C@H](O)CNC(=O)c1cnccc1Nc1cc(ncc1N(C)C)-c1cc(Cl)ccc1F |r| Show InChI InChI=1S/C22H23ClFN5O2/c1-13(30)10-27-22(31)16-11-25-7-6-18(16)28-20-9-19(26-12-21(20)29(2)3)15-8-14(23)4-5-17(15)24/h4-9,11-13,30H,10H2,1-3H3,(H,27,31)(H,25,26,28)/t13-/m0/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
Medivation Technologies LLC US Patent					Assay Description Compound of the invention were screened in an in vitro kinase assay against several members of the TGFβ family of Ser/Thr kinases. The kinases t...				US Patent US10030004 (2018) BindingDB Entry DOI: 10.7270/Q2QC05HQ
					More data for this Ligand-Target Pair