BDBM50452975 CHEMBL4210862

SMILES: NC(=N)NCCC[C@H](NC(=O)c1sccc1NS(=O)(=O)c1cc(cc2CCOc12)-c1ccccc1CN1CCCCC1)C(O)=O

InChI Key: InChIKey=RWHKDYPHVLIEGE-VWLOTQADSA-N

Data: 1 Kd

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 1 hit for monomerid = 50452975   

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
Neuropilin-1 (Homo sapiens (Human))	BDBM50452975 (CHEMBL4210862) Show SMILES NC(=N)NCCC[C@H](NC(=O)c1sccc1NS(=O)(=O)c1cc(cc2CCOc12)-c1ccccc1CN1CCCCC1)C(O)=O |r| Show InChI InChI=1S/C31H38N6O6S2/c32-31(33)34-12-6-9-25(30(39)40)35-29(38)28-24(11-16-44-28)36-45(41,42)26-18-22(17-20-10-15-43-27(20)26)23-8-3-2-7-21(23)19-37-13-4-1-5-14-37/h2-3,7-8,11,16-18,25,36H,1,4-6,9-10,12-15,19H2,(H,35,38)(H,39,40)(H4,32,33,34)/t25-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	2.28E+3	n/a	n/a	n/a	n/a	n/a
NCE Discovery (Domainex Ltd Curated by ChEMBL					Assay Description Binding affinity to N-terminal His6-tagged recombinant human NRP1-b1 domain expressed in Escherichia coli Rosetta Gami 2 (DE3) pLysS cells by SPR met...				J Med Chem 61: 4135-4154 (2018) Article DOI: 10.1021/acs.jmedchem.8b00210 BindingDB Entry DOI: 10.7270/Q2Q81GNK
					More data for this Ligand-Target Pair