BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Ephrin type-A receptor 2' and Ligand = 'BDBM50538248'   
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
Ephrin type-A receptor 2


(Homo sapiens (Human))		BDBM50538248
PNG
(CHEMBL4635141)
Show SMILES [H][C@]12CSCCC(=O)N3CN(CN(C3)C(=O)CCSC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)[C@H](C)NC1=O)C(C)C)C(=O)N[C@@H](C)C(N)=O)C(=O)CCSC[C@H](NC(=O)[C@H](C)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(O)=O)C(=O)N2 |r|
Show InChI InChI=1S/C80H121N21O23S4/c1-41(2)65-79(123)85-34-60(105)88-50(11-9-10-26-81)70(114)89-51(20-21-64(109)110)71(115)95-56-35-126-28-23-61(106)99-38-100(40-101(39-99)63(108)25-30-128-37-58(94-68(112)43(5)82)78(122)92-54(74(118)97-65)32-47-14-18-49(103)19-15-47)62(107)24-29-127-36-57(76(120)86-44(6)67(84)111)96-80(124)66(42(3)4)98-75(119)55(33-59(83)104)93-72(116)52(22-27-125-8)90-73(117)53(31-46-12-16-48(102)17-13-46)91-69(113)45(7)87-77(56)121/h12-19,41-45,50-58,65-66,102-103H,9-11,20-40,81-82H2,1-8H3,(H2,83,104)(H2,84,111)(H,85,123)(H,86,120)(H,87,121)(H,88,105)(H,89,114)(H,90,117)(H,91,113)(H,92,122)(H,93,116)(H,94,112)(H,95,115)(H,96,124)(H,97,118)(H,98,119)(H,109,110)/t43-,44-,45-,50-,51-,52-,53-,54-,55-,56-,57-,58-,65-,66-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem
Article
PubMed
 210n/an/an/an/an/an/an/an/a



BicycleTx Limited

Curated by ChEMBL


Assay Description
Binding affinity to 6x-His-tagged human EphA2 ecto-domain residues (Lys27 to Asn529 residues) expressed in HEK293 cells incubated for 60 mins by fluo...

J Med Chem 63: 4107-4116 (2020)


Article DOI: 10.1021/acs.jmedchem.9b02129
BindingDB Entry DOI: 10.7270/Q2474FC3
More data for this
Ligand-Target Pair