BDBM50314082 (S)-N1-((S)-1-((S)-1-((3S,11S,14S,20S,23S,32S,35S,41aS)-20-((1H-imidazol-4-yl)methyl)-3-((S)-4-amino-1-(2-((S)-2-carbamoylpyrrolidin-1-yl)-2-oxoethylamino)-1,4-dioxobutan-2-ylcarbamoyl)-23-benzyl-35-(4-hydroxybenzyl)-14-((R)-1-hydroxyethyl)-32-isobutyl-28,31-dimethyl-1,9,12,15,18,21,24,27,30,33,36,37-dodecaoxotetracontahydro-1H-pyrrolo[1,2-z][1,4,7,10,13,16,19,22,26,29,35]undecaazacyclononatriacontin-11-ylamino)-1-oxo-3-phenylpropan-2-ylamino)-5-guanidino-1-oxopentan-2-yl)-2-acetamidopentanediam::CHEMBL1089950
SMILES: CC(C)C[C@@H]1N(C)C(=O)CN(C)C(=O)CNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(=O)NCCCC[C@H](NC(=O)[C@@H]2CCCN2C(=O)C(=O)[C@H](Cc2ccc(O)cc2)NC1=O)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N1CCC[C@H]1C(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(C)=O)[C@@H](C)O
InChI Key: InChIKey=GRNGOJKQKRCTFF-BGGXCMKMSA-N
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
IgG receptor FcRn large subunit p51 (Homo sapiens (Human)) | BDBM50314082 ((S)-N1-((S)-1-((S)-1-((3S,11S,14S,20S,23S,32S,35S,...) | PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 2.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Syntonix Pharmaceuticals, Inc. Curated by ChEMBL | Assay Description Inhibition of IgG binding to soluble human FcRn after 5 hrs by competition ELISA | J Med Chem 53: 1587-96 (2010) Article DOI: 10.1021/jm901128z BindingDB Entry DOI: 10.7270/Q23R0T1H | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
IgG receptor FcRn large subunit p51 (Homo sapiens (Human)) | BDBM50314082 ((S)-N1-((S)-1-((S)-1-((3S,11S,14S,20S,23S,32S,35S,...) | PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | n/a | 1.80E+4 | n/a | n/a | n/a | 7.4 | n/a |
Syntonix Pharmaceuticals, Inc. Curated by ChEMBL | Assay Description Binding affinity to soluble human FcRn at pH 7.4 by surface plasmon resonance assay | J Med Chem 53: 1587-96 (2010) Article DOI: 10.1021/jm901128z BindingDB Entry DOI: 10.7270/Q23R0T1H | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
IgG receptor FcRn large subunit p51 (Homo sapiens (Human)) | BDBM50314082 ((S)-N1-((S)-1-((S)-1-((3S,11S,14S,20S,23S,32S,35S,...) | PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | n/a | 2.60E+3 | n/a | n/a | n/a | 6.0 | n/a |
Syntonix Pharmaceuticals, Inc. Curated by ChEMBL | Assay Description Binding affinity to soluble human FcRn at pH 6 by surface plasmon resonance assay | J Med Chem 53: 1587-96 (2010) Article DOI: 10.1021/jm901128z BindingDB Entry DOI: 10.7270/Q23R0T1H | |||||||||||
More data for this Ligand-Target Pair |