BDBM50518790 CHEMBL4465918

SMILES: Oc1cc2N(C[C@@H](CCl)c2c2ccccc12)C(=O)CCCC(=O)N1C[C@@H](CCl)c2c1cc(O)c1ccccc21

InChI Key: InChIKey=PHWPEULWFLWFAR-RTBURBONSA-N

Data: 6 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 6 hits for monomerid = 50518790   

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
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50518790 (CHEMBL4465918) Show SMILES Oc1cc2N(C[C@@H](CCl)c2c2ccccc12)C(=O)CCCC(=O)N1C[C@@H](CCl)c2c1cc(O)c1ccccc21 |r| Show InChI InChI=1S/C31H28Cl2N2O4/c32-14-18-16-34(24-12-26(36)20-6-1-3-8-22(20)30(18)24)28(38)10-5-11-29(39)35-17-19(15-33)31-23-9-4-2-7-21(23)27(37)13-25(31)35/h1-4,6-9,12-13,18-19,36-37H,5,10-11,14-17H2/t18-,19-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	530	n/a	n/a	n/a	n/a	n/a	n/a
Albert Ludwigs University Freiburg Curated by ChEMBL					Assay Description Inhibition of recombinant human N-terminal GST-tagged VEGFR2 (D807 to V1356 residues) expressed in sf9 cells using Poly(Glu,Tyr) 4:1 as substrate aft...				J Nat Prod 82: 16-26 (2019) Article DOI: 10.1021/acs.jnatprod.8b00233
					More data for this Ligand-Target Pair
Mast/stem cell growth factor receptor Kit (Homo sapiens (Human))	BDBM50518790 (CHEMBL4465918) Show SMILES Oc1cc2N(C[C@@H](CCl)c2c2ccccc12)C(=O)CCCC(=O)N1C[C@@H](CCl)c2c1cc(O)c1ccccc21 |r| Show InChI InChI=1S/C31H28Cl2N2O4/c32-14-18-16-34(24-12-26(36)20-6-1-3-8-22(20)30(18)24)28(38)10-5-11-29(39)35-17-19(15-33)31-23-9-4-2-7-21(23)27(37)13-25(31)35/h1-4,6-9,12-13,18-19,36-37H,5,10-11,14-17H2/t18-,19-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Albert Ludwigs University Freiburg Curated by ChEMBL					Assay Description Inhibition of recombinant human N-terminal GST/His6-tagged c-KIT (T544 to V976 residues) expressed in sf9 cells using Poly(Glu,Tyr) 4:1 as substrate ...				J Nat Prod 82: 16-26 (2019) Article DOI: 10.1021/acs.jnatprod.8b00233
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 1 (Homo sapiens (Human))	BDBM50518790 (CHEMBL4465918) Show SMILES Oc1cc2N(C[C@@H](CCl)c2c2ccccc12)C(=O)CCCC(=O)N1C[C@@H](CCl)c2c1cc(O)c1ccccc21 |r| Show InChI InChI=1S/C31H28Cl2N2O4/c32-14-18-16-34(24-12-26(36)20-6-1-3-8-22(20)30(18)24)28(38)10-5-11-29(39)35-17-19(15-33)31-23-9-4-2-7-21(23)27(37)13-25(31)35/h1-4,6-9,12-13,18-19,36-37H,5,10-11,14-17H2/t18-,19-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.28E+3	n/a	n/a	n/a	n/a	n/a	n/a
Albert Ludwigs University Freiburg Curated by ChEMBL					Assay Description Inhibition of recombinant human N-terminal GST-tagged VEGFR1 (K784 to I1338 residues) expressed in sf9 cells using Poly(Glu,Tyr) 4:1 as substrate aft...				J Nat Prod 82: 16-26 (2019) Article DOI: 10.1021/acs.jnatprod.8b00233
					More data for this Ligand-Target Pair
Focal adhesion kinase 1/vascular endothelial growth factor receptor 3 (Homo sapiens (Human))	BDBM50518790 (CHEMBL4465918) Show SMILES Oc1cc2N(C[C@@H](CCl)c2c2ccccc12)C(=O)CCCC(=O)N1C[C@@H](CCl)c2c1cc(O)c1ccccc21 |r| Show InChI InChI=1S/C31H28Cl2N2O4/c32-14-18-16-34(24-12-26(36)20-6-1-3-8-22(20)30(18)24)28(38)10-5-11-29(39)35-17-19(15-33)31-23-9-4-2-7-21(23)27(37)13-25(31)35/h1-4,6-9,12-13,18-19,36-37H,5,10-11,14-17H2/t18-,19-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Albert Ludwigs University Freiburg Curated by ChEMBL					Assay Description Inhibition of recombinant human N-terminal GST/His6-tagged VEGFR3 (N799 to R1298 residues) expressed in sf9 cells using Poly(Glu,Tyr) 4:1 as substrat...				J Nat Prod 82: 16-26 (2019) Article DOI: 10.1021/acs.jnatprod.8b00233
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL2 (Homo sapiens (Human))	BDBM50518790 (CHEMBL4465918) Show SMILES Oc1cc2N(C[C@@H](CCl)c2c2ccccc12)C(=O)CCCC(=O)N1C[C@@H](CCl)c2c1cc(O)c1ccccc21 |r| Show InChI InChI=1S/C31H28Cl2N2O4/c32-14-18-16-34(24-12-26(36)20-6-1-3-8-22(20)30(18)24)28(38)10-5-11-29(39)35-17-19(15-33)31-23-9-4-2-7-21(23)27(37)13-25(31)35/h1-4,6-9,12-13,18-19,36-37H,5,10-11,14-17H2/t18-,19-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	685	n/a	n/a	n/a	n/a	n/a	n/a
Albert Ludwigs University Freiburg Curated by ChEMBL					Assay Description Inhibition of recombinant human N-terminal GST/His6-tagged ABL2 (M1 to P650 residues) expressed in sf9 cells using Poly(Glu,Tyr) 4:1 as substrate aft...				J Nat Prod 82: 16-26 (2019) Article DOI: 10.1021/acs.jnatprod.8b00233
					More data for this Ligand-Target Pair
Alcohol dehydrogenase (Homo sapiens (Human))	BDBM50518790 (CHEMBL4465918) Show SMILES Oc1cc2N(C[C@@H](CCl)c2c2ccccc12)C(=O)CCCC(=O)N1C[C@@H](CCl)c2c1cc(O)c1ccccc21 |r| Show InChI InChI=1S/C31H28Cl2N2O4/c32-14-18-16-34(24-12-26(36)20-6-1-3-8-22(20)30(18)24)28(38)10-5-11-29(39)35-17-19(15-33)31-23-9-4-2-7-21(23)27(37)13-25(31)35/h1-4,6-9,12-13,18-19,36-37H,5,10-11,14-17H2/t18-,19-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	460	n/a	n/a	n/a	n/a	n/a	n/a
Albert Ludwigs University Freiburg Curated by ChEMBL					Assay Description Inhibition of ADH1 (unknown origin) preincubated for 2 hrs followed by substrate/NAD+ addition				J Nat Prod 82: 16-26 (2019) Article DOI: 10.1021/acs.jnatprod.8b00233
					More data for this Ligand-Target Pair