BDBM83205 (E,2S,3R)-2-amino-4-octadecene-1,3-diol::(E,2S,3R)-2-aminooctadec-4-ene-1,3-diol::(E,2S,3R)-2-azanyloctadec-4-ene-1,3-diol::MLS-0412588.0001::cid_5280335

SMILES: CCCCCCCCCCCCC\C=C\[C@@H](O)[C@@H](N)CO

InChI Key: InChIKey=WWUZIQQURGPMPG-KRWOKUGFSA-N

Data: 11 IC50  1 EC50

PDB links: 1 PDB ID matches 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 12 hits for monomerid = 83205   

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
streptokinase A precursor (Streptococcus pyogenes M1 GAS)	BDBM83205 ((E,2S,3R)-2-amino-4-octadecene-1,3-diol | (E,2S,3R...) Show SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@@H](N)CO Show InChI InChI=1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h14-15,17-18,20-21H,2-13,16,19H2,1H3/b15-14+/t17-,18+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	1.50E+5	n/a	n/a	n/a	n/a
Broad Institute Curated by PubChem BioAssay					Assay Description Keywords: Group A streptococcus, GAS, streptokinase, expression, virulence, inhibition, dose response, EC50 Assay Overview: The goal of this assa...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2736PBV
					More data for this Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N (Homo sapiens (Human))	BDBM83205 ((E,2S,3R)-2-amino-4-octadecene-1,3-diol | (E,2S,3R...) Show SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@@H](N)CO Show InChI InChI=1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h14-15,17-18,20-21H,2-13,16,19H2,1H3/b15-14+/t17-,18+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem Similars	PCBioAssay	n/a	n/a	6.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego CA...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2SB4462
					More data for this Ligand-Target Pair
Bfl-1 (Mus musculus (Mouse))	BDBM83205 ((E,2S,3R)-2-amino-4-octadecene-1,3-diol | (E,2S,3R...) Show SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@@H](N)CO Show InChI InChI=1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h14-15,17-18,20-21H,2-13,16,19H2,1H3/b15-14+/t17-,18+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem Similars	PCBioAssay	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego CA...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q25D8Q92
					More data for this Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N (Homo sapiens (Human))	BDBM83205 ((E,2S,3R)-2-amino-4-octadecene-1,3-diol | (E,2S,3R...) Show SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@@H](N)CO Show InChI InChI=1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h14-15,17-18,20-21H,2-13,16,19H2,1H3/b15-14+/t17-,18+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem Similars	PCBioAssay	n/a	n/a	6.43E+3	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego CA...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2X34VX0
					More data for this Ligand-Target Pair
Apelin receptor (Homo sapiens (Human))	BDBM83205 ((E,2S,3R)-2-amino-4-octadecene-1,3-diol | (E,2S,3R...) Show SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@@H](N)CO Show InChI InChI=1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h14-15,17-18,20-21H,2-13,16,19H2,1H3/b15-14+/t17-,18+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem Similars	PCBioAssay	n/a	n/a	>6.66E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute(SBMRI, San Diego, CA...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2B856NC
					More data for this Ligand-Target Pair
Protein kinase C, PKC; classical (Rattus norvegicus (Rat)-Rattus norvegicus (rat))	BDBM83205 ((E,2S,3R)-2-amino-4-octadecene-1,3-diol | (E,2S,3R...) Show SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@@H](N)CO Show InChI InChI=1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h14-15,17-18,20-21H,2-13,16,19H2,1H3/b15-14+/t17-,18+/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem Similars	PubMed	n/a	n/a	5.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
Nova Pharmaceutical Corporation Curated by ChEMBL					Assay Description In vitro inhibition of [32P] incorporation into histones by rat brain partially purified Protein kinase C in the presence of PMA, [Ca2+] and phosphat...				J Med Chem 34: 2928-31 (1991) BindingDB Entry DOI: 10.7270/Q2KH0NZG
					More data for this Ligand-Target Pair
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM83205 ((E,2S,3R)-2-amino-4-octadecene-1,3-diol | (E,2S,3R...) Show SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@@H](N)CO Show InChI InChI=1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h14-15,17-18,20-21H,2-13,16,19H2,1H3/b15-14+/t17-,18+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem Similars	Article	n/a	n/a	1.15E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was measured for its inhibitory activity against cholesteryl ester transfer protein (CETP)				Bioorg Med Chem Lett 7: 1481-1482 (1997) Article DOI: 10.1016/S0960-894X(97)00248-5 BindingDB Entry DOI: 10.7270/Q2SX6DR5
					More data for this Ligand-Target Pair
cAMP-Dependent Protein Kinase (PKA) (Rattus norvegicus (rat))	BDBM83205 ((E,2S,3R)-2-amino-4-octadecene-1,3-diol | (E,2S,3R...) Show SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@@H](N)CO Show InChI InChI=1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h14-15,17-18,20-21H,2-13,16,19H2,1H3/b15-14+/t17-,18+/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem Similars	PubMed	n/a	n/a	98	n/a	n/a	n/a	n/a	n/a	n/a
Nova Pharmaceutical Corporation Curated by ChEMBL					Assay Description Inhibition of cAMP-dependent kinase PKA(Protein kinase A) catalytic subunit at 100 uM				J Med Chem 34: 2928-31 (1991) BindingDB Entry DOI: 10.7270/Q2KH0NZG
					More data for this Ligand-Target Pair
Protein kinase C (PKC) (Rattus norvegicus)	BDBM83205 ((E,2S,3R)-2-amino-4-octadecene-1,3-diol | (E,2S,3R...) Show SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@@H](N)CO Show InChI InChI=1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h14-15,17-18,20-21H,2-13,16,19H2,1H3/b15-14+/t17-,18+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem Similars		n/a	n/a	2.34E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of Protein kinase C of rat brain using phosphatidyl serine: di-acyl glycerol (2:1)				Citation and Details BindingDB Entry DOI: 10.7270/Q21J9CZZ
					More data for this Ligand-Target Pair
Protein kinase C (PKC) (Rattus norvegicus)	BDBM83205 ((E,2S,3R)-2-amino-4-octadecene-1,3-diol | (E,2S,3R...) Show SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@@H](N)CO Show InChI InChI=1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h14-15,17-18,20-21H,2-13,16,19H2,1H3/b15-14+/t17-,18+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem Similars		n/a	n/a	6.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibitory concentration required against Protein kinase C (isolated from rat brain) in PKC assay performed with 4 ug phosphatidyl serine:diacylglyce...				Citation and Details BindingDB Entry DOI: 10.7270/Q21J9CZZ
					More data for this Ligand-Target Pair
Protein kinase C (PKC) (Rattus norvegicus)	BDBM83205 ((E,2S,3R)-2-amino-4-octadecene-1,3-diol | (E,2S,3R...) Show SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@@H](N)CO Show InChI InChI=1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h14-15,17-18,20-21H,2-13,16,19H2,1H3/b15-14+/t17-,18+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem Similars		n/a	n/a	2.34E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of Protein kinase C isolated from rat brain				Citation and Details BindingDB Entry DOI: 10.7270/Q2WS8WDS
					More data for this Ligand-Target Pair
C-C chemokine receptor type 6 (CCR6) (Homo sapiens (Human))	BDBM83205 ((E,2S,3R)-2-amino-4-octadecene-1,3-diol | (E,2S,3R...) Show SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@@H](N)CO Show InChI InChI=1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h14-15,17-18,20-21H,2-13,16,19H2,1H3/b15-14+/t17-,18+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem Similars	PCBioAssay	n/a	n/a	2.09E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute(SBMRI, San Diego, CA...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2QJ7FTF
					More data for this Ligand-Target Pair