BDBM50311959 6-methyl-4-(4-methyl-1H-indol-5-ylamino)-5-(4-(piperidin-1-ylsulfonyl)styryl)nicotinonitrile::CHEMBL1080114
SMILES: Cc1ncc(C#N)c(Nc2ccc3[nH]ccc3c2C)c1\C=C\c1ccc(cc1)S(=O)(=O)N1CCCCC1
InChI Key: InChIKey=LQEDBCPJDGQHCR-DHZHZOJOSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50311959 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 kinase C delta type
(Homo sapiens (Human)) | BDBM50311959
(6-methyl-4-(4-methyl-1H-indol-5-ylamino)-5-(4-(pip...)Show SMILES Cc1ncc(C#N)c(Nc2ccc3[nH]ccc3c2C)c1\C=C\c1ccc(cc1)S(=O)(=O)N1CCCCC1 Show InChI InChI=1S/C29H29N5O2S/c1-20-25-14-15-31-28(25)13-12-27(20)33-29-23(18-30)19-32-21(2)26(29)11-8-22-6-9-24(10-7-22)37(35,36)34-16-4-3-5-17-34/h6-15,19,31H,3-5,16-17H2,1-2H3,(H,32,33)/b11-8+ | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description Inhibition of PKCdelta |
Bioorg Med Chem Lett 19: 6575-7 (2009)
Article DOI: 10.1016/j.bmcl.2009.10.031 BindingDB Entry DOI: 10.7270/Q2KD1Z1F |
More data for this Ligand-Target Pair | |
Protein kinase C theta type
(Homo sapiens (Human)) | BDBM50311959
(6-methyl-4-(4-methyl-1H-indol-5-ylamino)-5-(4-(pip...)Show SMILES Cc1ncc(C#N)c(Nc2ccc3[nH]ccc3c2C)c1\C=C\c1ccc(cc1)S(=O)(=O)N1CCCCC1 Show InChI InChI=1S/C29H29N5O2S/c1-20-25-14-15-31-28(25)13-12-27(20)33-29-23(18-30)19-32-21(2)26(29)11-8-22-6-9-24(10-7-22)37(35,36)34-16-4-3-5-17-34/h6-15,19,31H,3-5,16-17H2,1-2H3,(H,32,33)/b11-8+ | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 68 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research
Curated by ChEMBL
| Assay Description Inhibition of PKCtheta |
Bioorg Med Chem Lett 19: 6575-7 (2009)
Article DOI: 10.1016/j.bmcl.2009.10.031 BindingDB Entry DOI: 10.7270/Q2KD1Z1F |
More data for this Ligand-Target Pair | |