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Compile Data Set for Download or QSAR

Found 275 hits of affinity data for UniProtKB/TrEMBL: Q9Y5X4    Zinc 0: unavailable per Zinc DB. Zinc 1: purchasable, 2 weeks to supply. Zinc 2: made on demand. Zinc 4: potentially available
Target
(Institution)
LigandTarget
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
photoreceptor-specific nuclear receptor


(Homo sapiens)
5-(3a-hydroxy-2-keto-3,4,6,6a-tetrahydro-1H-thien[3,4-d]imidazol-4-yl)valeric acid methyl ester
PNG
(5-(3a-hydroxy-2-oxo-3,4,6,6a-tetrahydro-1H-thieno[...)
Show SMILES COC(=O)CCCCC1SCC2NC(=O)NC12O
PDB

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PC cid
PC sid
ZINC 0

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PCBioAssay
n/an/a 139.1n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
6-[(4R,5S)-2-keto-5-methyl-imidazolidin-4-yl]hexanoic acid
PNG
(6-[(4R,5S)-5-methyl-2-oxidanylidene-imidazolidin-4...)
Show SMILES C[C@@H]1NC(=O)N[C@@H]1CCCCCC(O)=O
PDB

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ChEBI
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PC cid
PC sid
PDB
ZINC 0

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PCBioAssay
n/an/a 149.12n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
2-[[5-(benzofuran-2-yl)-4-methyl-1,2,4-triazol-3-yl]thio]-N-(3-bromophenyl)acetamide
PNG
(2-[[5-(1-benzofuran-2-yl)-4-methyl-1,2,4-triazol-3...)
Show SMILES Cn1c(SCC(=O)Nc2cccc(Br)c2)nnc1-c1cc2ccccc2o1
PDB

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n/an/a 167.27n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
[7-(4-fluorophenyl)-5-(p-tolyl)pyrido[2,3-d]pyrimidin-4-yl]amine
PNG
(7-(4-fluorophenyl)-5-(4-methylphenyl)-4-pyrido[2,3...)
Show SMILES Cc1ccc(cc1)-c1cc(nc2ncnc(N)c12)-c1ccc(F)cc1
PDB

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PCBioAssay
n/an/a 177.87n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
[5-phenyl-7-(p-tolyl)pyrido[2,3-d]pyrimidin-4-yl]amine
PNG
(7-(4-methylphenyl)-5-phenyl-4-pyrido[2,3-d]pyrimid...)
Show SMILES Cc1ccc(cc1)-c1cc(-c2ccccc2)c2c(N)ncnc2n1
PDB

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n/an/a 177.89n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
5-methyl-4-phenyl-cyclopenta[c]quinolizine-2,3-dicarboxylic acid dimethyl ester
PNG
(5-methyl-4-phenylcyclopenta[c]quinolizine-2,3-dica...)
Show SMILES COC(=O)c1cc2c(c1C(=O)OC)c(-c1ccccc1)c(C)c1ccccn21
PDB

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n/an/a 185.5n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
[7-(4-methoxyphenyl)-5-phenyl-pyrido[2,3-d]pyrimidin-4-yl]amine
PNG
(7-(4-methoxyphenyl)-5-phenyl-4-pyrido[2,3-d]pyrimi...)
Show SMILES COc1ccc(cc1)-c1cc(-c2ccccc2)c2c(N)ncnc2n1
PDB

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n/an/a 220.17n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
1-chloro-5-methyl-4-phenyl-cyclopenta[c]quinolizine-2,3-dicarboxylic acid dimethyl ester
PNG
(1-chloro-5-methyl-4-phenylcyclopenta[c]quinolizine...)
Show SMILES COC(=O)c1c(Cl)c2c(c1C(=O)OC)c(-c1ccccc1)c(C)c1ccccn21
PDB

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ZINC 0
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PCBioAssay
n/an/a 303.35n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
4-(4-butoxyphenyl)-5-cyano-2-methyl-N-phenyl-6-thioxo-1H-pyridine-3-carboxamide
PNG
(4-(4-butoxyphenyl)-5-cyano-2-methyl-N-phenyl-6-sul...)
Show SMILES CCCCOc1ccc(cc1)-c1c(C#N)c(=S)[nH]c(C)c1C(=O)Nc1ccccc1
PDB

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n/an/a 330.11n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
5-[(3aS,4R,6aS)-3a-hydroxy-2-keto-3,4,6,6a-tetrahydro-1H-thien[3,4-d]imidazol-4-yl]valeric acid methyl ester
PNG
(5-(6a-Hydroxy-2-oxo-hexahydro-thieno[3,4-d]imidazo...)
Show SMILES COC(=O)CCCC[C@H]1SC[C@H]2NC(=O)N[C@@]12O
PDB

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n/an/a 389.38n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
2-[[2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl]thio]-N-(3-fluoro-4-methyl-phenyl)acetamide
PNG
(2-[[2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-[1,2...)
Show SMILES Cc1n[nH]c(C)c1CCc1nc2c3ccccc3nc(SCC(=O)Nc3ccc(C)c(F)c3)n2n1
PDB

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ZINC 0
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PCBioAssay
n/an/a 473.9n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
1-[4-(dimethylamino)phenyl]-3-tosyl-urea
PNG
(({[4-(dimethylamino)anilino]carbonyl}amino)(4-meth...)
Show SMILES CN(C)c1ccc(NC(=O)NS(=O)(=O)c2ccc(C)cc2)cc1
PDB

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n/an/a 748.25n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
2-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)thio]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide
PNG
(2-[(4-allyl-5-phenyl-4H-1,2,4-triazol-3-yl)thio]-N...)
Show SMILES Cc1ccc2nc(sc2c1)-c1ccc(NC(=O)CSc2nnc(-c3ccccc3)n2CC=C)cc1
PDB

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ZINC 0
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n/an/a 774.16n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
N-(7-methylthiazolo[4,5-g][1,3]benzothiazol-2-yl)-2,3-dihydro-1,4-benzodioxin-6-carboxamide
PNG
(MLS000087912 | N-(7-methyl-2-thiazolo[4,5-g][1,3]b...)
Show SMILES Cc1nc2ccc3nc(NC(=O)c4ccc5OCCOc5c4)sc3c2s1
PDB

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n/an/a 812.55n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
4-methoxy-N-(7-methylthiazolo[4,5-g][1,3]benzothiazol-2-yl)benzamide
PNG
(4-methoxy-N-(7-methyl-2-thiazolo[4,5-g][1,3]benzot...)
Show SMILES COc1ccc(cc1)C(=O)Nc1nc2ccc3nc(C)sc3c2s1
PDB

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n/an/a 861.97n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
6-bromo-2-methyl-4-phenyl-quinoline-3-carboxylic acid
PNG
(6-bromanyl-2-methyl-4-phenyl-quinoline-3-carboxyli...)
Show SMILES Cc1nc2ccc(Br)cc2c(-c2ccccc2)c1C(O)=O
PDB

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ZINC 0
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n/an/a 1001.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
1-[2-(N-mesyl-4-phenoxy-anilino)acetyl]isonipecotamide
PNG
(1-[2-(N-methylsulfonyl-4-phenoxyanilino)-1-oxoethy...)
Show SMILES CS(=O)(=O)N(CC(=O)N1CCC(CC1)C(N)=O)c1ccc(Oc2ccccc2)cc1
PDB

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n/an/a 1055.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
6-(2-keto-5-methyl-imidazolidin-4-yl)-N-phenethyl-hexanamide
PNG
(6-(5-methyl-2-oxidanylidene-imidazolidin-4-yl)-N-(...)
Show SMILES CC1NC(=O)NC1CCCCCC(=O)NCCc1ccccc1
PDB

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n/an/a 1056.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
4-(5-methyl-2-furyl)-2-thioxo-5,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile
PNG
(4-(5-methyl-2-furanyl)-2-sulfanylidene-5,6,7,8-tet...)
Show SMILES Cc1ccc(o1)-c1c2CCCCc2[nH]c(=S)c1C#N
PDB

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n/an/a 1090.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
6-(4-fluorophenyl)-3-methyl-N-(6-methyl-2-pyridyl)imidazo[2,1-b]thiazole-2-carboxamide
PNG
(6-(4-fluorophenyl)-3-methyl-N-(6-methyl-2-pyridiny...)
Show SMILES Cc1c(sc2nc(cn12)-c1ccc(F)cc1)C(=O)Nc1cccc(C)n1
PDB

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n/an/a 1173.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
4-bromo-2-methyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylic acid
PNG
(4-bromanyl-2-methyl-7,8,9,10-tetrahydro-6H-cyclohe...)
Show SMILES Cc1cc(Br)c2nc3CCCCCc3c(C(O)=O)c2c1
PDB

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n/an/a 1378.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
6,8-dibromo-4-piperidino-quinazoline
PNG
(6,8-bis(bromanyl)-4-piperidin-1-yl-quinazoline | 6...)
Show SMILES Brc1cc(Br)c2ncnc(N3CCCCC3)c2c1
PDB

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n/an/a 1421.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
2-(2,4-dichlorophenoxy)-N-[4-(6-morpholinopyridazin-3-yl)phenyl]acetamide
PNG
(2-(2,4-dichlorophenoxy)-N-[4-(6-morpholin-4-ylpyri...)
Show SMILES Clc1ccc(OCC(=O)Nc2ccc(cc2)-c2ccc(nn2)N2CCOCC2)c(Cl)c1
PDB

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n/an/a 1426.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
3-(3,4-dimethoxyphenyl)-N-[2-[(4-fluorobenzyl)amino]-2-keto-ethyl]-4-keto-phthalazine-1-carboxamide
PNG
(3-(3,4-dimethoxyphenyl)-N-[2-[(4-fluorophenyl)meth...)
Show SMILES COc1ccc(cc1OC)-n1nc(C(=O)NCC(=O)NCc2ccc(F)cc2)c2ccccc2c1=O
PDB

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n/an/a 1457.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
5-methyl-4-phenyl-cyclopenta[c]quinolizine-1,2-dicarboxylic acid dimethyl ester
PNG
(5-methyl-4-phenylcyclopenta[c]quinolizine-1,2-dica...)
Show SMILES COC(=O)c1cc2c(-c3ccccc3)c(C)c3ccccn3c2c1C(=O)OC
PDB

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n/an/a>1476.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
5,5-dimethyl-2-thioxo-1,6-dihydrobenzo[h]quinazolin-4-one
PNG
(5,5-Dimethyl-2-thioxo-2,3,5,6-tetrahydro-1H-benzo[...)
Show SMILES CC1(C)Cc2ccccc2-c2[nH]c(=S)[nH]c(=O)c12
PDB

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n/an/a>1476.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
2-(8-chloro-4-keto-2-thioxo-1H-benzofuro[3,2-d]pyrimidin-3-yl)acetic acid ethyl ester
PNG
(2-(8-chloro-4-oxo-2-sulfanylidene-1H-benzofuro[3,2...)
Show SMILES CCOC(=O)Cn1c(=S)[nH]c2c3cc(Cl)ccc3oc2c1=O
PDB

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n/an/a 1492.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
N-[2-(3-pyridyl)-1,3-benzoxazol-5-yl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide
PNG
(MLS000765462 | N-(2-pyridin-3-yl-1,3-benzoxazol-5-...)
Show SMILES O=C(Nc1ccc2oc(nc2c1)-c1cccnc1)c1ccc2OCCOc2c1
PDB

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n/an/a 1613.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
potassium;6-bromo-2-(3-pyridyl)cinchoninate
PNG
(MLS000727574 | SMR000306271 | cid_23679856 | potas...)
Show SMILES [O-]C(=O)c1cc(nc2ccc(Br)cc12)-c1cccnc1
PDB

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n/an/a 1636.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
cid_929935
PNG
(5-Isopropyl-10-thioxo-1,2,3,4,10,11-hexahydro-9H-7...)
Show SMILES CC(C)c1nc2sc3c([nH]c(=S)[nH]c3=O)c2c2CCCCc12
PDB

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n/an/a 1903.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
1-[2-(4-methoxyphenyl)-3,4-dimethyl-pyrazolo[3,4-d]pyridazin-7-yl]-N-(2-methylbenzyl)isonipecotamide
PNG
(1-[2-(4-methoxyphenyl)-3,4-dimethyl-7-pyrazolo[3,4...)
Show SMILES COc1ccc(cc1)-n1nc2c(nnc(C)c2c1C)N1CCC(CC1)C(=O)NCc1ccccc1C
PDB

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n/an/a 2011.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
1-(4,6-dimethyl-2-pyridyl)-3-(3-methoxyphenyl)thiourea
PNG
(1-(4,6-dimethyl-2-pyridinyl)-3-(3-methoxyphenyl)th...)
Show SMILES COc1cccc(NC(=S)Nc2cc(C)cc(C)n2)c1
PDB

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n/an/a 2039.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
3-(4-fluorophenyl)-2-thioxo-1H-benzofuro[3,2-d]pyrimidin-4-one
PNG
(3-(4-fluorophenyl)-2-sulfanylidene-1H-[1]benzofuro...)
Show SMILES Fc1ccc(cc1)-n1c(=S)[nH]c2c3ccccc3oc2c1=O
PDB

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n/an/a 2092.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
N-(4-methoxyphenyl)-2-[[4-phenyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetamide
PNG
(MLS000048934 | N-(4-methoxyphenyl)-2-[(4-phenyl-5-...)
Show SMILES COc1ccc(NC(=O)CSc2nnc(-c3cccs3)n2-c2ccccc2)cc1
PDB

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n/an/a 2093.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
N-(2-ketochromen-6-yl)-3-methoxy-2-naphthamide
PNG
(3-Methoxy-naphthalene-2-carboxylic acid (2-oxo-2H-...)
Show SMILES COc1cc2ccccc2cc1C(=O)Nc1ccc2oc(=O)ccc2c1
PDB

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n/an/a 2280.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
3-(4-methoxyphenyl)-2-thioxo-1H-benzofuro[3,2-d]pyrimidin-4-one
PNG
(3-(4-methoxyphenyl)-2-sulfanylidene-1H-[1]benzofur...)
Show SMILES COc1ccc(cc1)-n1c(=S)[nH]c2c3ccccc3oc2c1=O
PDB

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n/an/a 2320.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
3-(2-ketochromen-3-yl)-N-(2-methyl-3-oxazolo[4,5-b]pyridin-2-yl-phenyl)benzamide
PNG
(MLS000581554 | N-(2-methyl-3-[1,3]oxazolo[4,5-b]py...)
Show SMILES Cc1c(NC(=O)c2cccc(c2)-c2cc3ccccc3oc2=O)cccc1-c1nc2ncccc2o1
PDB

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n/an/a 2331.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-2-(2-keto-4-methyl-chromen-7-yl)oxy-acetamide
PNG
(MLS000579861 | N-[5-(diethylsulfamoyl)-2-methoxy-p...)
Show SMILES CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)COc2ccc3c(C)cc(=O)oc3c2)c1
PDB

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n/an/a 2351.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
N-[4-(1,3-benzothiazol-2-yl)thiazol-2-yl]-2-furamide
PNG
(MLS000102877 | N-[4-(1,3-benzothiazol-2-yl)-1,3-th...)
Show SMILES O=C(Nc1nc(cs1)-c1nc2ccccc2s1)c1ccco1
PDB

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n/an/a 2438.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
2-(5-keto-2,4-dimethyl-thieno[3,4]pyrrolo[1,3-d]pyridazin-6-yl)-N-phenethyl-acetamide
PNG
(2-(2,4-Dimethyl-5-oxo-4,5-dihydro-thieno[2',3&...)
Show SMILES Cc1cc2n(C)c3c(cnn(CC(=O)NCCc4ccccc4)c3=O)c2s1
PDB

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n/an/a 2520.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
2-[[5-(benzofuran-2-yl)-4-methyl-1,2,4-triazol-3-yl]thio]-N-(3-fluorophenyl)acetamide
PNG
(2-[[5-(1-benzofuran-2-yl)-4-methyl-1,2,4-triazol-3...)
Show SMILES Cn1c(SCC(=O)Nc2cccc(F)c2)nnc1-c1cc2ccccc2o1
PDB

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n/an/a 2605.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
1-piperidino-2-[[6-(2-thienyl)pyridazin-3-yl]thio]ethanone
PNG
(1-(1-piperidinyl)-2-[(6-thiophen-2-yl-3-pyridaziny...)
Show SMILES O=C(CSc1ccc(nn1)-c1cccs1)N1CCCCC1
PDB

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n/an/a 2636.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
(4-fluorobenzyl)-([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)amine
PNG
(MLS000522409 | N-[(4-fluorophenyl)methyl]-[1,2,4]t...)
Show SMILES Fc1ccc(CNc2nc3ccccc3n3cnnc23)cc1
PDB

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n/an/a 2695.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
5-chloro-2-methoxy-N-[3-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)phenyl]benzamide
PNG
(5-chloranyl-2-methoxy-N-[3-([1,2,4]triazolo[4,3-b]...)
Show SMILES COc1ccc(Cl)cc1C(=O)Nc1cccc(c1)-c1ccc2nncn2n1
PDB

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n/an/a 2861.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
N-[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-piperonylamide
PNG
(MLS000050497 | N-[4-(5-methyl-1,3-benzoxazol-2-yl)...)
Show SMILES Cc1ccc2oc(nc2c1)-c1ccc(NC(=O)c2ccc3OCOc3c2)cc1
PDB

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n/an/a 2875.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
6-bromo-N-[(1-methylpyrazol-4-yl)methyl]-2-(p-tolyl)cinchoninamide
PNG
(6-bromanyl-2-(4-methylphenyl)-N-[(1-methylpyrazol-...)
Show SMILES Cc1ccc(cc1)-c1cc(C(=O)NCc2cnn(C)c2)c2cc(Br)ccc2n1
PDB

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n/an/a 2992.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
3-phenyl-2-thioxo-1H-benzofuro[3,2-d]pyrimidin-4-one
PNG
(3-phenyl-2-sulfanylidene-1H-[1]benzofuro[3,2-d]pyr...)
Show SMILES O=c1n(-c2ccccc2)c(=S)[nH]c2c3ccccc3oc12
PDB

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n/an/a 3055.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
5,10-dihydrothiazolo[4,5-b][1,5]benzodiazepin-2-one
PNG
(5,10-dihydro-[1,3]thiazolo[4,5-b][1,5]benzodiazepi...)
Show SMILES O=c1[nH]c2Nc3ccccc3N=Cc2s1
PDB

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n/an/a 3136.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
6-chloro-N-(3-thiazolo[5,4-b]pyridin-2-ylphenyl)nicotinamide
PNG
(6-chloranyl-N-[3-([1,3]thiazolo[5,4-b]pyridin-2-yl...)
Show SMILES Clc1ccc(cn1)C(=O)Nc1cccc(c1)-c1nc2cccnc2s1
PDB

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n/an/a 3372.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
photoreceptor-specific nuclear receptor


(Homo sapiens)
5-bromo-N-[4-(6-methoxypyridazin-3-yl)phenyl]-2-furamide
PNG
(5-bromanyl-N-[4-(6-methoxypyridazin-3-yl)phenyl]fu...)
Show SMILES COc1ccc(nn1)-c1ccc(NC(=O)c2ccc(Br)o2)cc1
PDB

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n/an/a 3383.0n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair
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