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BDBM50524834 CHEMBL4435255

SMILES: CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](C)N1CC\C=C/CC(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C1=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O

InChI Key: InChIKey=NMUGIQNATVGVKI-DQNVLLNPSA-N

Data: 1 Kd

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50524834   
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
HIF1A/p300/CREB-binding protein


(Homo sapiens (Human))
BDBM50524834
PNG
(CHEMBL4435255)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](C)N1CC\C=C/CC(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C1=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O |r,c:29|
Show InChI InChI=1S/C44H73N13O14/c1-22(2)19-29(41(69)55-30(21-35(62)63)42(70)52-26(36(46)64)13-15-32(45)58)54-37(65)24(5)50-39(67)27(11-10-17-49-44(47)48)53-38(66)25(6)57-18-9-7-8-12-33(59)51-28(14-16-34(60)61)40(68)56-31(43(57)71)20-23(3)4/h7-8,22-31H,9-21H2,1-6H3,(H2,45,58)(H2,46,64)(H,50,67)(H,51,59)(H,52,70)(H,53,66)(H,54,65)(H,55,69)(H,56,68)(H,60,61)(H,62,63)(H4,47,48,49)/b8-7-/t24-,25-,26-,27-,28-,29-,30-,31-/m0/s1
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 690n/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Binding affinity to p300 (unknown origin)


J Med Chem 62: 5725-5749 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01596
More data for this
Ligand-Target Pair