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BDBM232058 US9340517, 446

SMILES: C[C@@H](CN1CC[C@H](CNC(=O)c2ccc3ccccc3c2)N[C@H](CCN2CCCCC2)C1=O)c1ccc(Cl)cc1

InChI Key: InChIKey=XPBDPPLRPHGTCD-RWIFEVTBSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 232058   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Melanocortin receptor 5 (MC5R)


(Homo sapiens (Human))
BDBM232058
PNG
(US9340517, 446)
Show SMILES C[C@@H](CN1CC[C@H](CNC(=O)c2ccc3ccccc3c2)N[C@H](CCN2CCCCC2)C1=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C33H41ClN4O2/c1-24(25-11-13-29(34)14-12-25)23-38-20-15-30(36-31(33(38)40)16-19-37-17-5-2-6-18-37)22-35-32(39)28-10-9-26-7-3-4-8-27(26)21-28/h3-4,7-14,21,24,30-31,36H,2,5-6,15-20,22-23H2,1H3,(H,35,39)/t24-,30+,31+/m0/s1
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UniProtKB/SwissProt

antibodypedia
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a<1.00E+4n/an/an/an/a7.437



Mimetica PTY LTD

US Patent


Assay Description
Assessments of compound binding to human MC5R (hMC5R)) by displacement of an 125I-labeled NDP-MSH receptor ligand peptide were performed essentially ...


US Patent US9340517 (2016)


BindingDB Entry DOI: 10.7270/Q2PV6J8X
More data for this
Ligand-Target Pair