BDBM200814 US9670255, Compound 29

SMILES: OC(=O)CCCCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=N)N[C@H]12

InChI Key: InChIKey=IAJKFHSLWUNBII-HUBLWGQQSA-N

Data: 1 Kd

PDB links: 3 PDB IDs match this monomer.

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 = 200814   

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
Streptavidin [37-163,Y46S,N47D,S51D,Y107S,R108K,E125D,R127K,E140N] (Streptomyces avidinii)	BDBM200814 (US9670255, Compound 29) Show SMILES OC(=O)CCCCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=N)N[C@H]12 |r| Show InChI InChI=1S/C16H28N4O3S/c17-16-19-11-10-24-12(15(11)20-16)6-3-4-7-13(21)18-9-5-1-2-8-14(22)23/h11-12,15H,1-10H2,(H,18,21)(H,22,23)(H3,17,19,20)/t11-,12-,15-/m0/s1	PDB GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB US Patent	n/a	n/a	n/a	154	n/a	n/a	n/a	n/a	n/a
SAVID THERAPEUTICS INC. US Patent					Assay Description The amount of a ligand immobilized on a sensor chip was adjusted within the range of 1608 RU to 8042 RU, so as to suppress mass transport limitation....				US Patent US9670255 (2017) BindingDB Entry DOI: 10.7270/Q298855H
					More data for this Ligand-Target Pair				3D Structure (crystal)