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Compile Data Set for Download or QSAR

Found 1 hit of kd for UniProtKB: P20340   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Ras-related protein Rab-6A


(Homo sapiens)		BDBM50540838
PNG
(CHEMBL4635206)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(O)=O |r|
Show InChI InChI=1S/C95H138N22O30/c1-47(2)34-62(86(137)108-64(36-49(5)6)88(139)116-71(45-118)94(145)113-66(38-53-20-14-11-15-21-53)91(142)115-69(42-73(99)121)85(136)102-51(9)79(130)117-78(50(7)8)95(146)147)110-92(143)68(40-55-44-100-46-101-55)114-90(141)67(39-54-23-25-56(119)26-24-54)112-87(138)63(35-48(3)4)109-89(140)65(37-52-18-12-10-13-19-52)111-84(135)59(27-30-72(98)120)104-83(134)60(28-31-74(122)123)105-81(132)58(22-16-17-33-96)103-82(133)61(29-32-75(124)125)106-93(144)70(43-77(128)129)107-80(131)57(97)41-76(126)127/h10-15,18-21,23-26,44,46-51,57-71,78,118-119H,16-17,22,27-43,45,96-97H2,1-9H3,(H2,98,120)(H2,99,121)(H,100,101)(H,102,136)(H,103,133)(H,104,134)(H,105,132)(H,106,144)(H,107,131)(H,108,137)(H,109,140)(H,110,143)(H,111,135)(H,112,138)(H,113,145)(H,114,141)(H,115,142)(H,116,139)(H,117,130)(H,122,123)(H,124,125)(H,126,127)(H,128,129)(H,146,147)/t51-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-,71-,78-/m0/s1
PDB
MMDB

Reactome pathway

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 2.00E+4n/an/an/an/an/a



University of Naples "Federico II"

Curated by ChEMBL


Assay Description
Binding affinity to RAB6A (unknown origin) assessed as inhibition of RAB6A/RAB61IP1 protein-protein interaction

ACS Med Chem Lett 11: 1047-1053 (2020)


Article DOI: 10.1021/acsmedchemlett.9b00620
BindingDB Entry DOI: 10.7270/Q20K2D3J
More data for this
Ligand-Target Pair