UCSF
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Analogs

40423223
40423223

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Popular Name: 7-[2-[3-(3-chlorophenoxy)-2-hydroxy-propoxy]-3,5-dihydroxy-cyclopentyl]hept-5-enoic 7-[2-[3-(3-chlorophenoxy)-2-hydr…

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Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
PF2R-1-E Prostaglandin F2-alpha Receptor (cluster #1 Of 1), Eukaryotic Eukaryotes 680 0.30 Binding ≤ 10μM
PF2R-1-E Prostaglandin F2-alpha Receptor (cluster #1 Of 1), Eukaryotic Eukaryotes 52 0.35 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
PF2R_BOVIN P37289 Prostanoid FP Receptor, Bovin 680 0.30 Binding ≤ 1μM
PF2R_BOVIN P37289 Prostanoid FP Receptor, Bovin 680 0.30 Binding ≤ 10μM
PF2R_MOUSE P43117 Prostaglandin F2-alpha Receptor, Mouse 52.4 0.35 Functional ≤ 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) 2.51 3.88 -52.91 3 7 -1 119 427.901 12 ↓
Lo Low (pH 4.5-6) 2.51 1.9 -13.67 4 7 0 116 428.909 12 ↓

Parameters Provided:

ring.id = 245987
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 = 245987 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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