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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Leukocyte surface antigen CD47' and Ligand = 'BDBM50192017'   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Leukocyte surface antigen CD47


(Homo sapiens (Human))		BDBM50192017
PNG
(CHEMBL3899400)
Show SMILES CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](N)CCCCN)C(C)C)C(=O)N[C@@H](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/C66H101N17O12/c1-38(2)54(63(92)75-40(5)56(85)79-53(36-43-37-74-47-22-10-9-20-45(43)47)61(90)77-48(23-12-15-31-68)58(87)78-50(65(94)95)24-13-16-32-69)83-64(93)55(39(3)4)82-62(91)52(35-42-26-28-44(84)29-27-42)81-60(89)51(34-41-18-7-6-8-19-41)80-59(88)49(25-17-33-73-66(71)72)76-57(86)46(70)21-11-14-30-67/h6-10,18-20,22,26-29,37-40,46,48-55,74,84H,11-17,21,23-25,30-36,67-70H2,1-5H3,(H,75,92)(H,76,86)(H,77,90)(H,78,87)(H,79,85)(H,80,88)(H,81,89)(H,82,91)(H,83,93)(H,94,95)(H4,71,72,73)/t40-,46+,48-,49-,50+,51-,52-,53-,54-,55-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/an/a 4.20E+4n/an/an/an/an/a



Sorbonne Universit£s

Curated by ChEMBL


Assay Description
Binding affinity to CD47 receptor in human biotinylated MEC1 cell membranes by biolayer interferometry

J Med Chem 59: 8412-21 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00781
BindingDB Entry DOI: 10.7270/Q2251M4K
More data for this
Ligand-Target Pair