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BDBM130479 US8822494, 25

SMILES: Cc1ncnc(N2CC(F)C2)c1-c1ccc(Oc2nccc3[nH]ccc23)cc1F

InChI Key: InChIKey=CFRREJQRARCNGC-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 130479   
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
D(1A) dopamine receptor


(Homo sapiens (Human))		BDBM130479
PNG
(US8822494, 25)
Show SMILES Cc1ncnc(N2CC(F)C2)c1-c1ccc(Oc2nccc3[nH]ccc23)cc1F |(-1.47,-5.63,;-2.8,-4.86,;-4.14,-5.63,;-5.47,-4.86,;-5.47,-3.32,;-4.14,-2.55,;-4.14,-1.01,;-3.05,.08,;-4.14,1.17,;-4.14,2.71,;-5.23,.08,;-2.8,-3.32,;-1.47,-2.55,;-1.47,-1.01,;-.14,-.24,;1.2,-1.01,;2.53,-.24,;2.53,1.3,;3.86,2.07,;3.86,3.61,;2.53,4.38,;1.2,3.61,;-.27,4.09,;-1.17,2.84,;-.27,1.6,;1.2,2.07,;1.2,-2.55,;-.14,-3.32,;-.14,-4.86,)|
Show InChI InChI=1S/C21H17F2N5O/c1-12-19(20(27-11-26-12)28-9-13(22)10-28)15-3-2-14(8-17(15)23)29-21-16-4-6-24-18(16)5-7-25-21/h2-8,11,13,24H,9-10H2,1H3
PDB

KEGG

UniProtKB/SwissProt

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antibodypedia
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PC cid
PC sid
UniChem
US Patent
 5.09n/an/an/an/an/an/an/an/a



Pfizer Inc.

US Patent


Assay Description
The affinity of the compounds described herein was determined by competition binding assays similar to those described in Ryman-Rasmussen et al., Dif...

US Patent US8822494 (2014)


BindingDB Entry DOI: 10.7270/Q27S7MFN
More data for this
Ligand-Target Pair