Found 2 hits Enz. Inhib. hit(s) with Target = 'Leukocyte surface antigen CD47' and Ligand = 'BDBM50530412' 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 |
|---|
Leukocyte surface antigen CD47
(Homo sapiens (Human)) | BDBM50530412
(CHEMBL4462459)Show SMILES CC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)N(C)C(=O)[C@H](N)CCCCN)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](CCCCN)C(O)=O |r| Show InChI InChI=1S/C69H107N17O12/c1-40(2)56(64(93)82-54(38-45-39-77-49-24-12-11-22-47(45)49)61(90)78-50(25-14-17-33-71)59(88)79-51(68(97)98)26-15-18-34-72)84-66(95)58(42(5)6)85-65(94)57(41(3)4)83-62(91)53(37-44-28-30-46(87)31-29-44)80-60(89)52(36-43-20-9-8-10-21-43)81-63(92)55(27-19-35-76-69(74)75)86(7)67(96)48(73)23-13-16-32-70/h8-12,20-22,24,28-31,39-42,48,50-58,77,87H,13-19,23,25-27,32-38,70-73H2,1-7H3,(H,78,90)(H,79,88)(H,80,89)(H,81,92)(H,82,93)(H,83,91)(H,84,95)(H,85,94)(H,97,98)(H4,74,75,76)/t48-,50+,51-,52+,53+,54+,55+,56+,57+,58+/m1/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | 9.50E+3 | n/a | n/a | n/a | n/a | n/a |
Sorbonne Universit£
Curated by ChEMBL
| Assay Description
Binding affinity to CD47 in biotinylated human MEC1 cell membranes by biolayer interferometry |
J Med Chem 62: 7656-7668 (2019)
Article DOI: 10.1021/acs.jmedchem.9b00024
BindingDB Entry DOI: 10.7270/Q2MW2MMF |
More data for this
Ligand-Target Pair | |
Leukocyte surface antigen CD47
(Homo sapiens (Human)) | BDBM50530412
(CHEMBL4462459)Show SMILES CC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)N(C)C(=O)[C@H](N)CCCCN)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](CCCCN)C(O)=O |r| Show InChI InChI=1S/C69H107N17O12/c1-40(2)56(64(93)82-54(38-45-39-77-49-24-12-11-22-47(45)49)61(90)78-50(25-14-17-33-71)59(88)79-51(68(97)98)26-15-18-34-72)84-66(95)58(42(5)6)85-65(94)57(41(3)4)83-62(91)53(37-44-28-30-46(87)31-29-44)80-60(89)52(36-43-20-9-8-10-21-43)81-63(92)55(27-19-35-76-69(74)75)86(7)67(96)48(73)23-13-16-32-70/h8-12,20-22,24,28-31,39-42,48,50-58,77,87H,13-19,23,25-27,32-38,70-73H2,1-7H3,(H,78,90)(H,79,88)(H,80,89)(H,81,92)(H,82,93)(H,83,91)(H,84,95)(H,85,94)(H,97,98)(H4,74,75,76)/t48-,50+,51-,52+,53+,54+,55+,56+,57+,58+/m1/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | 9.50E+3 | n/a | n/a | n/a | n/a | n/a |
Sorbonne Universit£
Curated by ChEMBL
| Assay Description
Binding affinity to CD47 in biotinylated human MEC1 cell membranes by biolayer interferometry |
J Med Chem 62: 7656-7668 (2019)
Article DOI: 10.1021/acs.jmedchem.9b00024
BindingDB Entry DOI: 10.7270/Q2MW2MMF |
More data for this
Ligand-Target Pair | |
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