UCSF

ZINC03936308

Substance Information

In ZINC since Heavy atoms Benign functionality
October 20th, 2005 40 No

Download: MOL2 SDF SMILES Flexibase

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) 4.64 -3.53 -47.67 3 7 1 83 550.716 17

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
SSR1-1-E Somatostatin Receptor 1 (cluster #1 Of 1), Eukaryotic Eukaryotes 5900 0.18 Binding ≤ 10μM
SSR2-1-E Somatostatin Receptor 2 (cluster #1 Of 1), Eukaryotic Eukaryotes 5900 0.18 Binding ≤ 10μM
SSR3-1-E Somatostatin Receptor 3 (cluster #1 Of 1), Eukaryotic Eukaryotes 3000 0.19 Binding ≤ 10μM
SSR4-1-E Somatostatin Receptor 4 (cluster #1 Of 1), Eukaryotic Eukaryotes 5900 0.18 Binding ≤ 10μM
SSR5-1-E Somatostatin Receptor 5 (cluster #1 Of 1), Eukaryotic Eukaryotes 3000 0.19 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
SSR1_MOUSE P30873 Somatostatin Receptor 1, Mouse 5900 0.18 Binding ≤ 10μM
SSR1_HUMAN P30872 Somatostatin Receptor 1, Human 2400 0.20 Binding ≤ 10μM
SSR2_MOUSE P30875 Somatostatin Receptor 2, Mouse 5900 0.18 Binding ≤ 10μM
SSR2_HUMAN P30874 Somatostatin Receptor 2, Human 4600 0.19 Binding ≤ 10μM
SSR3_HUMAN P32745 Somatostatin Receptor 3, Human 3000 0.19 Binding ≤ 10μM
SSR3_MOUSE P30935 Somatostatin Receptor 3, Mouse 5900 0.18 Binding ≤ 10μM
SSR4_MOUSE P49660 Somatostatin Receptor 4, Mouse 5900 0.18 Binding ≤ 10μM
SSR4_HUMAN P31391 Somatostatin Receptor 4, Human 2000 0.20 Binding ≤ 10μM
SSR5_MOUSE O08858 Somatostatin Receptor 5, Mouse 5900 0.18 Binding ≤ 10μM
SSR5_HUMAN P35346 Somatostatin Receptor 5, Human 3000 0.19 Binding ≤ 10μM

Reactome Annotations from Targets (via Uniprot)

Description Species
G alpha (i) signalling events
Peptide ligand-binding receptors

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