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Compile Data Set for Download or QSAR

Found 1 hit of kd data for polymerid = 187,50006749   
Target
(Institution)
LigandTarget
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
Transcription factor AP-1


(Homo sapiens (Human))
BDBM50326017
PNG
(Ac-WRIARLEEKVKTLKAQNSELASTANMLREQVAQLKQKVCC-NH2 | ...)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(N)=O
Show InChI InChI=1S/C200H344N62O59S3/c1-28-101(18)155(260-178(302)120(53-43-78-221-200(217)218)237-186(310)135(228-109(26)267)85-110-88-222-112-45-30-29-44-111(110)112)195(319)226-105(22)160(284)229-118(51-41-76-219-198(213)214)167(291)248-133(83-96(8)9)184(308)242-127(60-68-150(278)279)171(295)241-125(58-66-148(274)275)169(293)233-116(49-34-39-74-204)176(300)258-153(99(14)15)193(317)245-117(50-35-40-75-205)179(303)261-157(108(25)266)197(321)252-134(84-97(10)11)185(309)234-113(46-31-36-71-201)164(288)223-102(19)159(283)230-122(55-63-143(207)269)173(297)251-137(87-147(211)273)188(312)254-138(89-263)189(313)243-128(61-69-151(280)281)174(298)247-130(80-93(2)3)181(305)224-103(20)163(287)253-139(90-264)190(314)262-156(107(24)265)196(320)227-106(23)162(286)246-136(86-146(210)272)187(311)244-129(70-79-324-27)175(299)250-132(82-95(6)7)183(307)236-119(52-42-77-220-199(215)216)166(290)240-126(59-67-149(276)277)170(294)239-124(57-65-145(209)271)180(304)257-152(98(12)13)192(316)225-104(21)161(285)231-121(54-62-142(206)268)172(296)249-131(81-94(4)5)182(306)235-114(47-32-37-72-202)165(289)238-123(56-64-144(208)270)168(292)232-115(48-33-38-73-203)177(301)259-154(100(16)17)194(318)256-141(92-323)191(315)255-140(91-322)158(212)282/h29-30,44-45,88,93-108,113-141,152-157,222,263-266,322-323H,28,31-43,46-87,89-92,201-205H2,1-27H3,(H2,206,268)(H2,207,269)(H2,208,270)(H2,209,271)(H2,210,272)(H2,211,273)(H2,212,282)(H,223,288)(H,224,305)(H,225,316)(H,226,319)(H,227,320)(H,228,267)(H,229,284)(H,230,283)(H,231,285)(H,232,292)(H,233,293)(H,234,309)(H,235,306)(H,236,307)(H,237,310)(H,238,289)(H,239,294)(H,240,290)(H,241,295)(H,242,308)(H,243,313)(H,244,311)(H,245,317)(H,246,286)(H,247,298)(H,248,291)(H,249,296)(H,250,299)(H,251,297)(H,252,321)(H,253,287)(H,254,312)(H,255,315)(H,256,318)(H,257,304)(H,258,300)(H,259,301)(H,260,302)(H,261,303)(H,262,314)(H,274,275)(H,276,277)(H,278,279)(H,280,281)(H4,213,214,219)(H4,215,216,220)(H4,217,218,221)/t101-,102-,103-,104-,105-,106-,107+,108+,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,152-,153-,154-,155-,156-,157-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/an/a 1.00E+4n/an/an/an/an/a



Yale University

Curated by ChEMBL


Assay Description
Binding affinity to wild-type c-Jun homodimer at by circular dichroism spectroscopy


Citation and Details
More data for this
Ligand-Target Pair