BDBM50423606 Antirobe::CLINDAMYCIN::Chlorodeoxylincomycin::Chlorolincomycin::Cleocin::Cleocin T::Evoclin::Sobelin::U-21251

SMILES: CCC[C@@H]1C[C@H](N(C)C1)C(=O)N[C@H]([C@H](C)Cl)[C@@]1(C)O[C@H](SC)[C@H](O)[C@@H](O)[C@H]1O

InChI Key: InChIKey=AXGWQMGSKOZGLA-AWPCGBSGSA-N

Data: 1 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 1 hit for monomerid = 50423606   

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
protein-arginine deiminase type-4 (Homo sapiens (Human))	BDBM50423606 (Antirobe | CLINDAMYCIN | Chlorodeoxylincomycin | C...) Show SMILES CCC[C@@H]1C[C@H](N(C)C1)C(=O)N[C@H]([C@H](C)Cl)[C@@]1(C)O[C@H](SC)[C@H](O)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C19H35ClN2O5S/c1-6-7-11-8-12(22(4)9-11)17(26)21-15(10(2)20)19(3)16(25)13(23)14(24)18(27-19)28-5/h10-16,18,23-25H,6-9H2,1-5H3,(H,21,26)/t10-,11+,12-,13+,14+,15+,16+,18+,19+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.10E+6	n/a	n/a	n/a	n/a	n/a	n/a
University of South Carolina Curated by ChEMBL					Assay Description Inhibition of PAD4 by ABPP-based assay				Bioorg Med Chem 16: 739-45 (2008) Article DOI: 10.1016/j.bmc.2007.10.021 BindingDB Entry DOI: 10.7270/Q24F1RKF
					More data for this Ligand-Target Pair