BDBM50265131 CHEMBL4093570

SMILES: CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H](C(C)C)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=OJIKYIYXKCWDMH-IFLLZMBLSA-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 = 50265131   

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
Homo sapiens furin (paired basic amino acid cleaving enzyme) (FURIN), mRNA (Homo sapiens (Human))	BDBM50265131 (CHEMBL4093570) Show SMILES CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H](C(C)C)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/C50H88N14O8/c1-27(2)23-37(58-32(11)65)47(70)64-41(31(9)10)49(72)62-39(25-29(5)6)46(69)61-38(24-28(3)4)45(68)59-36(16-14-22-56-50(54)55)44(67)63-40(30(7)8)48(71)60-35(15-12-13-21-51)43(66)57-26-33-17-19-34(20-18-33)42(52)53/h17-20,27-31,35-41H,12-16,21-26,51H2,1-11H3,(H3,52,53)(H,57,66)(H,58,65)(H,59,68)(H,60,71)(H,61,69)(H,62,72)(H,63,67)(H,64,70)(H4,54,55,56)/t35-,36-,37-,38-,39-,40-,41-/m0/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD 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 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
Subtilisin/kexin type 6 (Homo sapiens (Human))	BDBM50265131 (CHEMBL4093570) Show SMILES CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H](C(C)C)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/C50H88N14O8/c1-27(2)23-37(58-32(11)65)47(70)64-41(31(9)10)49(72)62-39(25-29(5)6)46(69)61-38(24-28(3)4)45(68)59-36(16-14-22-56-50(54)55)44(67)63-40(30(7)8)48(71)60-35(15-12-13-21-51)43(66)57-26-33-17-19-34(20-18-33)42(52)53/h17-20,27-31,35-41H,12-16,21-26,51H2,1-11H3,(H3,52,53)(H,57,66)(H,58,65)(H,59,68)(H,60,71)(H,61,69)(H,62,72)(H,63,67)(H,64,70)(H4,54,55,56)/t35-,36-,37-,38-,39-,40-,41-/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