BDBM50265129 CHEMBL4085824

SMILES: CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)NCc1ccc(cc1)C(N)=N

InChI Key: InChIKey=FIVKUUAVZKXJBD-ZTYVOHGWSA-N

Data: 2 KI

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 2 hits for monomerid = 50265129   

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
Subtilisin/kexin type 6 (Homo sapiens (Human))	BDBM50265129 (CHEMBL4085824) Show SMILES CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)NCc1ccc(cc1)C(N)=N |r| Show InChI InChI=1S/C48H84N14O9/c1-26(2)21-35(56-30(9)64)43(67)61-38(25-63)46(70)60-37(23-28(5)6)45(69)59-36(22-27(3)4)44(68)57-34(14-12-20-54-48(52)53)42(66)62-39(29(7)8)47(71)58-33(13-10-11-19-49)41(65)55-24-31-15-17-32(18-16-31)40(50)51/h15-18,26-29,33-39,63H,10-14,19-25,49H2,1-9H3,(H3,50,51)(H,55,65)(H,56,64)(H,57,68)(H,58,71)(H,59,69)(H,60,70)(H,61,67)(H,62,66)(H4,52,53,54)/t33-,34-,35-,36-,37-,38-,39-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Gdansk Curated by ChEMBL					Assay Description Inhibition of recombinant human PACE4 expressed in drosophila S2 cells using pyrGlu-Arg-Thr-Lys-Arg-7-amido-4-methylcoumarin as substrate after 60 mi...				J Med Chem 60: 2732-2744 (2017) Article DOI: 10.1021/acs.jmedchem.6b01499 BindingDB Entry DOI: 10.7270/Q2HD7Z4F
					More data for this Ligand-Target Pair
Homo sapiens furin (paired basic amino acid cleaving enzyme) (FURIN), mRNA (Homo sapiens (Human))	BDBM50265129 (CHEMBL4085824) Show SMILES CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)NCc1ccc(cc1)C(N)=N |r| Show InChI InChI=1S/C48H84N14O9/c1-26(2)21-35(56-30(9)64)43(67)61-38(25-63)46(70)60-37(23-28(5)6)45(69)59-36(22-27(3)4)44(68)57-34(14-12-20-54-48(52)53)42(66)62-39(29(7)8)47(71)58-33(13-10-11-19-49)41(65)55-24-31-15-17-32(18-16-31)40(50)51/h15-18,26-29,33-39,63H,10-14,19-25,49H2,1-9H3,(H3,50,51)(H,55,65)(H,56,64)(H,57,68)(H,58,71)(H,59,69)(H,60,70)(H,61,67)(H,62,66)(H4,52,53,54)/t33-,34-,35-,36-,37-,38-,39-/m0/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	2.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Gdansk Curated by ChEMBL					Assay Description Inhibition of recombinant human furin expressed in drosophila S2 cells using pyrGlu-Arg-Thr-Lys-Arg-7-amido-4-methylcoumarin as substrate after 60 mi...				J Med Chem 60: 2732-2744 (2017) Article DOI: 10.1021/acs.jmedchem.6b01499 BindingDB Entry DOI: 10.7270/Q2HD7Z4F
					More data for this Ligand-Target Pair