UCSF
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Popular Name: 3-[[3-(4-pyridyl)-2,6-naphthyridin-1-yl]amino]propan-1-ol 3-[[3-(4-pyridyl)-2,6-naphthyrid…

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Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
KPCA-5-E Protein Kinase C Alpha (cluster #5 Of 6), Eukaryotic Eukaryotes 1000 0.40 Binding ≤ 10μM
KPCD-1-E Protein Kinase C Delta (cluster #1 Of 4), Eukaryotic Eukaryotes 963 0.40 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
KPCA_HUMAN P17252 Protein Kinase C Alpha, Human 1000 0.40 Binding ≤ 1μM
KPCD_HUMAN Q05655 Protein Kinase C Delta, Human 963 0.40 Binding ≤ 1μM
KPCA_HUMAN P17252 Protein Kinase C Alpha, Human 1000 0.40 Binding ≤ 10μM
KPCD_HUMAN Q05655 Protein Kinase C Delta, Human 963 0.40 Binding ≤ 10μM

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.18 3.39 -10.48 2 5 0 71 280.331 5 ↓
Lo Low (pH 4.5-6) 1.18 3.85 -41.4 3 5 1 72 281.339 5 ↓

Parameters Provided:

ring.id = 192426
filter.purchasability = annotated
page.format = targets
page.num = 1

Structural Results Found: (before additional filtering)

SQL Query Was

SELECT DISTINCT(ci.sub_id_fk) AS sub_id FROM catalog_item AS ci INNER JOIN catalog AS c ON ci.cat_id_fk=c.cat_id INNER JOIN hasring AS hr ON ci.sub_id_fk=hr.sub_id_fk INNER JOIN rings AS r ON hr.rings_fk=r.rings_id  WHERE r.rings_id = 192426 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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