UCSF

ZINC30320665

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) -5.03 -14.08 -161 7 19 -2 303 564.286 9

Vendor Notes

Note Type Comments Provided By
UniProt Database Links 5GT1_PERFR; 5GT2_PERFR; 5GT_GENTR; 5GT_VERHY; 5NTD_LUTLO; 5NTD_RHIMP; AA5GT_DIACA; ACEA_GLUXY; ACSA1_GLUHA; ACSA1_GLUXY; ACSA2_GLUHA; AGLF_HALVD; AGLM_HALVD; AGS1_SCHPO; ALG5_DICDI; ALG5_DROME; ALG5_HUMAN; ALG5_MOUSE; ALG5_SCHPO; ALG5_YEAST; AMGDS_ACHLA ChEBI
UniProt Database Links AGLF_HALVD; ALG5_DICDI; ALG5_DROME; ALG5_HUMAN; ALG5_MOUSE; ALG5_SCHPO; ALG5_YEAST; AOG_PHAAN; ARAE1_ARATH; CEGTA_XENLA; CEGTB_XENLA; CEGT_HUMAN; CEGT_MOUSE; CEGT_RAT; CEGT_XENTR; CELA_GLUXY; CGT1_CAEEL; CGT2_CAEEL; CGT3_CAEEL; CGT_FRAAN; CRTX_ESCVU; CRTX ChEBI
PUBCHEM_PATENT_ID EP0359347A2; EP0359347B1; EP0380470B1; EP0414171A2; EP0414171B1; EP0471687B1; EP0497878B1; EP0576592A1; EP0576592B1; EP0635063A1; EP0635063B1; EP0642526A1; EP0642526B1; EP0671917A1; EP0728841A3; EP0748868A2; EP0771878A1; EP0816489A1; EP0850244A1; EP085851 IBM Patent Data
Reactome Database Links REACT_115635; REACT_118657; REACT_120743; REACT_1315; REACT_15538; REACT_169102; REACT_169150; REACT_169159; REACT_169223; REACT_169252; REACT_169306; REACT_169355; REACT_169387; REACT_169406; REACT_18318; REACT_2047; REACT_22143; REACT_22239; REACT_22287 ChEBI
Patent Database Links US2003170653 ChEBI

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
P2RY2-1-E Purinergic Receptor P2Y2 (cluster #1 Of 1), Eukaryotic Eukaryotes 10000 0.19 Functional ≤ 10μM
P2RY6-1-E Pyrimidinergic Receptor P2Y6 (cluster #1 Of 1), Eukaryotic Eukaryotes 1600 0.23 Functional ≤ 10μM
P2Y14-1-E P2Y Purinoceptor 14 (cluster #1 Of 2), Eukaryotic Eukaryotes 400 0.25 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
P2Y14_HUMAN Q15391 Purinergic Receptor P2Y14, Human 261 0.26 Functional ≤ 10μM
P2RY2_HUMAN P41231 Purinergic Receptor P2Y2, Human 10000 0.19 Functional ≤ 10μM
P2RY6_HUMAN Q15077 Pyrimidinergic Receptor P2Y6, Human 1600 0.23 Functional ≤ 10μM

Direct Reactome Annotations (via ChEBI)

Description Species
Collagen biosynthesis and modifying enzymes
Formation of the active cofactor, UDP-glucuronate
G alpha (i) signalling events
Galactose catabolism
Glycogen synthesis
Glycosphingolipid metabolism
HS-GAG biosynthesis
Keratan sulfate biosynthesis
P2Y receptors
Pre-NOTCH Processing in the Endoplasmic Reticulum
Synthesis of dolichyl-phosphate-glucose
Transport of nucleotide sugars
Trehalose biosynthesis

Reactome Annotations from Targets (via Uniprot)

Description Species
G alpha (i) signalling events
G alpha (q) signalling events
P2Y receptors

Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.