Found 2 hits Enz. Inhib. hit(s) with Target = 'IgG receptor FcRn large subunit p51' and Ligand = 'BDBM50270815' Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kJ/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)) | BDBM50270815
((2S)-1-{2-[(2S)-2-[(2R)-2-{[(2S)-1-[(2S)-2-[(2S)-2...)Show SMILES CC(C)C[C@H](NC(=O)CNC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)CCC(N)=O)C(C)(C)S)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N1CCC[C@H]1C(O)=O |r,wU:88.90,103.108,128.134,71.74,27.35,49.59,4.4,41.43,113.117,82.86,wD:60.70,16.24,45.47,107.111,(34.1,-23.52,;34.1,-25.07,;35.44,-25.83,;32.77,-25.83,;32.77,-27.38,;31.43,-28.14,;30.1,-27.37,;30.1,-25.83,;28.77,-28.14,;27.44,-27.37,;26.11,-28.15,;26.11,-29.69,;24.77,-27.38,;23.44,-28.15,;22.1,-27.38,;22.1,-25.84,;20.77,-28.15,;20.77,-29.69,;22.1,-30.46,;23.43,-29.69,;24.76,-30.46,;24.77,-32,;23.44,-32.77,;22.1,-32.01,;19.44,-27.38,;18.11,-28.17,;18.11,-29.7,;16.78,-27.39,;16.78,-25.85,;18.11,-25.08,;19.52,-25.71,;20.55,-24.56,;19.77,-23.23,;18.27,-23.55,;15.43,-28.14,;14.09,-27.38,;14.09,-25.84,;12.76,-28.15,;11.43,-27.38,;10.09,-28.15,;10.09,-29.69,;8.75,-27.38,;7.42,-28.15,;6.09,-27.38,;6.09,-25.83,;4.76,-28.15,;3.43,-27.38,;2.1,-28.16,;2.1,-29.7,;.76,-27.39,;.76,-25.85,;2.1,-25.08,;3.44,-25.86,;4.77,-25.08,;4.77,-23.54,;3.42,-22.78,;2.1,-23.55,;-.58,-28.15,;-1.91,-27.39,;-1.91,-25.84,;-3.24,-28.16,;-3.24,-29.69,;-1.91,-30.47,;-1.91,-32,;-.57,-32.77,;-.56,-34.31,;-1.91,-35.08,;.76,-35.08,;-4.56,-27.37,;-5.88,-28.17,;-5.88,-29.71,;-7.21,-27.4,;-8.57,-28.15,;-7.21,-25.86,;-5.88,-25.09,;-5.88,-23.55,;-7.21,-22.78,;-4.54,-22.78,;4.76,-29.69,;6.31,-29.69,;3.22,-29.68,;4.76,-31.23,;8.75,-25.83,;7.43,-25.07,;10.09,-25.06,;34.1,-28.15,;34.1,-29.69,;35.44,-27.38,;36.76,-28.15,;38.1,-27.38,;38.1,-25.83,;36.78,-25.07,;36.77,-23.53,;38.1,-22.76,;38.1,-21.21,;39.44,-23.52,;39.45,-25.06,;36.76,-29.69,;35.44,-30.46,;38.1,-30.46,;39.67,-29.93,;40.7,-31.26,;39.75,-32.64,;38.35,-31.96,;37.12,-32.89,;35.7,-32.28,;37.3,-34.42,;36.08,-35.36,;34.66,-34.75,;33.43,-35.68,;36.26,-36.88,;37.67,-37.49,;35.02,-37.8,;35.21,-39.32,;36.63,-39.93,;36.81,-41.46,;35.58,-42.37,;38.23,-42.06,;33.98,-40.24,;32.56,-39.65,;34.16,-41.77,;32.93,-42.7,;33.12,-44.22,;34.54,-44.83,;31.89,-45.15,;31.78,-46.83,;30.16,-47.26,;29.25,-45.84,;30.42,-44.82,;30.04,-43.33,;28.55,-42.93,;31.12,-42.24,)| Show InChI InChI=1S/C84H120N24O22S2/c1-44(2)31-53(74(121)103-58(34-48-22-24-50(110)25-23-48)81(128)108-30-13-20-60(108)78(125)104-59(42-131)77(124)102-57(36-63(87)112)72(119)95-41-67(116)107-29-14-21-61(107)82(129)130)97-65(114)39-92-64(113)38-93-71(118)54(32-46-15-8-6-9-16-46)100-75(122)56(35-49-37-90-43-96-49)98-66(115)40-94-79(126)68(45(3)109)105-80(127)69(84(4,5)132)106-76(123)55(33-47-17-10-7-11-18-47)101-73(120)52(19-12-28-91-83(88)89)99-70(117)51(85)26-27-62(86)111/h6-11,15-18,22-25,37,43-45,51-61,68-69,109-110,131-132H,12-14,19-21,26-36,38-42,85H2,1-5H3,(H2,86,111)(H2,87,112)(H,90,96)(H,92,113)(H,93,118)(H,94,126)(H,95,119)(H,97,114)(H,98,115)(H,99,117)(H,100,122)(H,101,120)(H,102,124)(H,103,121)(H,104,125)(H,105,127)(H,106,123)(H,129,130)(H4,88,89,91)/t45-,51+,52+,53+,54+,55+,56+,57+,58+,59+,60+,61+,68+,69-/m1/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Syntonix Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human IgG binding to soluble human FcRn by ELISA |
Bioorg Med Chem 16: 6394-405 (2008)
Article DOI: 10.1016/j.bmc.2008.05.004
BindingDB Entry DOI: 10.7270/Q2QV3M9C |
More data for this
Ligand-Target Pair | |
IgG receptor FcRn large subunit p51
(Homo sapiens (Human)) | BDBM50270815
((2S)-1-{2-[(2S)-2-[(2R)-2-{[(2S)-1-[(2S)-2-[(2S)-2...)Show SMILES CC(C)C[C@H](NC(=O)CNC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)CCC(N)=O)C(C)(C)S)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N1CCC[C@H]1C(O)=O |r,wU:88.90,103.108,128.134,71.74,27.35,49.59,4.4,41.43,113.117,82.86,wD:60.70,16.24,45.47,107.111,(34.1,-23.52,;34.1,-25.07,;35.44,-25.83,;32.77,-25.83,;32.77,-27.38,;31.43,-28.14,;30.1,-27.37,;30.1,-25.83,;28.77,-28.14,;27.44,-27.37,;26.11,-28.15,;26.11,-29.69,;24.77,-27.38,;23.44,-28.15,;22.1,-27.38,;22.1,-25.84,;20.77,-28.15,;20.77,-29.69,;22.1,-30.46,;23.43,-29.69,;24.76,-30.46,;24.77,-32,;23.44,-32.77,;22.1,-32.01,;19.44,-27.38,;18.11,-28.17,;18.11,-29.7,;16.78,-27.39,;16.78,-25.85,;18.11,-25.08,;19.52,-25.71,;20.55,-24.56,;19.77,-23.23,;18.27,-23.55,;15.43,-28.14,;14.09,-27.38,;14.09,-25.84,;12.76,-28.15,;11.43,-27.38,;10.09,-28.15,;10.09,-29.69,;8.75,-27.38,;7.42,-28.15,;6.09,-27.38,;6.09,-25.83,;4.76,-28.15,;3.43,-27.38,;2.1,-28.16,;2.1,-29.7,;.76,-27.39,;.76,-25.85,;2.1,-25.08,;3.44,-25.86,;4.77,-25.08,;4.77,-23.54,;3.42,-22.78,;2.1,-23.55,;-.58,-28.15,;-1.91,-27.39,;-1.91,-25.84,;-3.24,-28.16,;-3.24,-29.69,;-1.91,-30.47,;-1.91,-32,;-.57,-32.77,;-.56,-34.31,;-1.91,-35.08,;.76,-35.08,;-4.56,-27.37,;-5.88,-28.17,;-5.88,-29.71,;-7.21,-27.4,;-8.57,-28.15,;-7.21,-25.86,;-5.88,-25.09,;-5.88,-23.55,;-7.21,-22.78,;-4.54,-22.78,;4.76,-29.69,;6.31,-29.69,;3.22,-29.68,;4.76,-31.23,;8.75,-25.83,;7.43,-25.07,;10.09,-25.06,;34.1,-28.15,;34.1,-29.69,;35.44,-27.38,;36.76,-28.15,;38.1,-27.38,;38.1,-25.83,;36.78,-25.07,;36.77,-23.53,;38.1,-22.76,;38.1,-21.21,;39.44,-23.52,;39.45,-25.06,;36.76,-29.69,;35.44,-30.46,;38.1,-30.46,;39.67,-29.93,;40.7,-31.26,;39.75,-32.64,;38.35,-31.96,;37.12,-32.89,;35.7,-32.28,;37.3,-34.42,;36.08,-35.36,;34.66,-34.75,;33.43,-35.68,;36.26,-36.88,;37.67,-37.49,;35.02,-37.8,;35.21,-39.32,;36.63,-39.93,;36.81,-41.46,;35.58,-42.37,;38.23,-42.06,;33.98,-40.24,;32.56,-39.65,;34.16,-41.77,;32.93,-42.7,;33.12,-44.22,;34.54,-44.83,;31.89,-45.15,;31.78,-46.83,;30.16,-47.26,;29.25,-45.84,;30.42,-44.82,;30.04,-43.33,;28.55,-42.93,;31.12,-42.24,)| Show InChI InChI=1S/C84H120N24O22S2/c1-44(2)31-53(74(121)103-58(34-48-22-24-50(110)25-23-48)81(128)108-30-13-20-60(108)78(125)104-59(42-131)77(124)102-57(36-63(87)112)72(119)95-41-67(116)107-29-14-21-61(107)82(129)130)97-65(114)39-92-64(113)38-93-71(118)54(32-46-15-8-6-9-16-46)100-75(122)56(35-49-37-90-43-96-49)98-66(115)40-94-79(126)68(45(3)109)105-80(127)69(84(4,5)132)106-76(123)55(33-47-17-10-7-11-18-47)101-73(120)52(19-12-28-91-83(88)89)99-70(117)51(85)26-27-62(86)111/h6-11,15-18,22-25,37,43-45,51-61,68-69,109-110,131-132H,12-14,19-21,26-36,38-42,85H2,1-5H3,(H2,86,111)(H2,87,112)(H,90,96)(H,92,113)(H,93,118)(H,94,126)(H,95,119)(H,97,114)(H,98,115)(H,99,117)(H,100,122)(H,101,120)(H,102,124)(H,103,121)(H,104,125)(H,105,127)(H,106,123)(H,129,130)(H4,88,89,91)/t45-,51+,52+,53+,54+,55+,56+,57+,58+,59+,60+,61+,68+,69-/m1/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 250 | n/a | n/a | n/a | 6.0 | n/a |
Syntonix Pharmaceuticals, Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human FcRn at pH 6 by surface plasmon resonance assay |
Bioorg Med Chem 16: 6394-405 (2008)
Article DOI: 10.1016/j.bmc.2008.05.004
BindingDB Entry DOI: 10.7270/Q2QV3M9C |
More data for this
Ligand-Target Pair | |
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