BDBM50260017 CHEMBL4069234

SMILES: CCN1CCN(Cc2cc(NC(=O)c3ccc4C(C)CN(Cc4c3)c3cncnc3)cc(c2)C(F)(F)F)CC1

InChI Key: InChIKey=QIYCVICASXFGFF-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50260017   

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
Discoidin domain-containing receptor 2 (Homo sapiens (Human))	BDBM50260017 (CHEMBL4069234) Show SMILES CCN1CCN(Cc2cc(NC(=O)c3ccc4C(C)CN(Cc4c3)c3cncnc3)cc(c2)C(F)(F)F)CC1 Show InChI InChI=1S/C29H33F3N6O/c1-3-36-6-8-37(9-7-36)17-21-10-24(29(30,31)32)13-25(11-21)35-28(39)22-4-5-27-20(2)16-38(18-23(27)12-22)26-14-33-19-34-15-26/h4-5,10-15,19-20H,3,6-9,16-18H2,1-2H3,(H,35,39)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	944	n/a	n/a	n/a	n/a	n/a	n/a
Jinan University Curated by ChEMBL					Assay Description Inhibition of recombinant human GST-tagged DDR2 cytoplasmic domain expressed in baculovirus expression system using Fluorescein-Poly GAT as substrate...				ACS Med Chem Lett 8: 327-332 (2017) Article DOI: 10.1021/acsmedchemlett.6b00497 BindingDB Entry DOI: 10.7270/Q2N0190M
					More data for this Ligand-Target Pair
Bcr-Abl (Homo sapiens (Human))	BDBM50260017 (CHEMBL4069234) Show SMILES CCN1CCN(Cc2cc(NC(=O)c3ccc4C(C)CN(Cc4c3)c3cncnc3)cc(c2)C(F)(F)F)CC1 Show InChI InChI=1S/C29H33F3N6O/c1-3-36-6-8-37(9-7-36)17-21-10-24(29(30,31)32)13-25(11-21)35-28(39)22-4-5-27-20(2)16-38(18-23(27)12-22)26-14-33-19-34-15-26/h4-5,10-15,19-20H,3,6-9,16-18H2,1-2H3,(H,35,39)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Jinan University Curated by ChEMBL					Assay Description Inhibition of recombinant human full length His-tagged Bcr-Abl fusion protein cytoplasmic domain expressed in baculovirus expression system using tyr...				ACS Med Chem Lett 8: 327-332 (2017) Article DOI: 10.1021/acsmedchemlett.6b00497 BindingDB Entry DOI: 10.7270/Q2N0190M
					More data for this Ligand-Target Pair
Mast/stem cell growth factor receptor Kit (Homo sapiens (Human))	BDBM50260017 (CHEMBL4069234) Show SMILES CCN1CCN(Cc2cc(NC(=O)c3ccc4C(C)CN(Cc4c3)c3cncnc3)cc(c2)C(F)(F)F)CC1 Show InChI InChI=1S/C29H33F3N6O/c1-3-36-6-8-37(9-7-36)17-21-10-24(29(30,31)32)13-25(11-21)35-28(39)22-4-5-27-20(2)16-38(18-23(27)12-22)26-14-33-19-34-15-26/h4-5,10-15,19-20H,3,6-9,16-18H2,1-2H3,(H,35,39)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Jinan University Curated by ChEMBL					Assay Description Inhibition of recombinant human His-tagged c-kit cytoplasmic domain (544 to 976 residues) expressed in baculovirus expression system using Ser/Thr 6 ...				ACS Med Chem Lett 8: 327-332 (2017) Article DOI: 10.1021/acsmedchemlett.6b00497 BindingDB Entry DOI: 10.7270/Q2N0190M
					More data for this Ligand-Target Pair
Epithelial discoidin domain-containing receptor 1 (Homo sapiens (Human))	BDBM50260017 (CHEMBL4069234) Show SMILES CCN1CCN(Cc2cc(NC(=O)c3ccc4C(C)CN(Cc4c3)c3cncnc3)cc(c2)C(F)(F)F)CC1 Show InChI InChI=1S/C29H33F3N6O/c1-3-36-6-8-37(9-7-36)17-21-10-24(29(30,31)32)13-25(11-21)35-28(39)22-4-5-27-20(2)16-38(18-23(27)12-22)26-14-33-19-34-15-26/h4-5,10-15,19-20H,3,6-9,16-18H2,1-2H3,(H,35,39)	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	71	n/a	n/a	n/a	n/a	n/a	n/a
Jinan University Curated by ChEMBL					Assay Description Inhibition of recombinant human GST-tagged DDR1 catalytic domain expressed in baculovirus expression system using Fluorescein-Poly GAT as substrate m...				ACS Med Chem Lett 8: 327-332 (2017) Article DOI: 10.1021/acsmedchemlett.6b00497 BindingDB Entry DOI: 10.7270/Q2N0190M
					More data for this Ligand-Target Pair