Binding 10μM Binding 1μM Functional 10μM ADME/T 10μM
| Name (Code) | Description | Organism Class | Size | Browse | Download (Annotations) |
|---|---|---|---|---|---|
| Z104302-3-O | Glutamate NMDA receptor (cluster #3 of 7) | Other | 7 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH1-4-E | Carbonic anhydrase I (cluster #4 of 12) | Eukaryotes | 6 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH2-13-E | Carbonic anhydrase II (cluster #13 of 15) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DCAM-1-E | S-adenosylmethionine decarboxylase 1 (cluster #1 of 3) | Eukaryotes | 5 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH12-9-E | Carbonic anhydrase XII (cluster #9 of 9) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH9-3-E | Carbonic anhydrase IX (cluster #3 of 11) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CDK1-2-E | Cyclin-dependent kinase 1 (cluster #2 of 4) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NMDZ1-4-E | Glutamate (NMDA) receptor subunit zeta 1 (cluster #4 of 6) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q2PCB5-2-E | Carbonic anhydrase (cluster #2 of 2) | Eukaryotes | 4 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AA1R-2-E | Adenosine A1 receptor (cluster #2 of 4) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AA2AR-1-E | Adenosine A2a receptor (cluster #1 of 4) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH14-2-E | Carbonic anhydrase XIV (cluster #2 of 8) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH14-4-E | Carbonic anhydrase XIV (cluster #4 of 8) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH2-5-E | Carbonic anhydrase II (cluster #5 of 15) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH4-3-E | Carbonic anhydrase IV (cluster #3 of 16) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH4-6-E | Carbonic anhydrase IV (cluster #6 of 16) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH5A-4-E | Carbonic anhydrase VA (cluster #4 of 10) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH5B-4-E | Carbonic anhydrase VB (cluster #4 of 9) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH5B-5-E | Carbonic anhydrase VB (cluster #5 of 9) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH6-2-E | Carbonic anhydrase VI (cluster #2 of 8) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH6-3-E | Carbonic anhydrase VI (cluster #3 of 8) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH7-2-E | Carbonic anhydrase VII (cluster #2 of 8) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH7-3-E | Carbonic anhydrase VII (cluster #3 of 8) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GLCM-2-E | Glucosylceramidase (cluster #2 of 2) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM4-3-E | Metabotropic glutamate receptor 4 (cluster #3 of 3) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM6-1-E | Metabotropic glutamate receptor 6 (cluster #1 of 1) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GUAD-1-E | Guanine deaminase (cluster #1 of 1) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LOX5-2-E | Arachidonate 5-lipoxygenase (cluster #2 of 6) | Eukaryotes | 3 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AA2BR-1-E | Adenosine A2b receptor (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AA3R-2-E | Adenosine receptor A3 (cluster #2 of 6) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADK-1-E | Adenosine kinase (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ALDR-5-E | Aldose reductase (cluster #5 of 5) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AROA-1-B | 5-enolpyruvylshikimate-3-phosphate synthase (cluster #1 of 2) | Bacteria | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH12-2-E | Carbonic anhydrase XII (cluster #2 of 9) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH13-1-E | Carbonic anhydrase XIII (cluster #1 of 7) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH15-3-E | Carbonic anhydrase 15 (cluster #3 of 6) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH3-1-E | Carbonic anhydrase III (cluster #1 of 6) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH3-2-E | Carbonic anhydrase III (cluster #2 of 6) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH4-5-E | Carbonic anhydrase IV (cluster #5 of 16) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH5A-6-E | Carbonic anhydrase VA (cluster #6 of 10) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH9-4-E | Carbonic anhydrase IX (cluster #4 of 11) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| EGLN1-2-E | Egl nine homolog 1 (cluster #2 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FOLH1-1-E | Glutamate carboxypeptidase II (cluster #1 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GLNA-1-B | Glutamine synthetase (cluster #1 of 1) | Bacteria | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GPR17-1-E | Uracil nucleotide/cysteinyl leukotriene receptor (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIA1-3-E | Glutamate receptor ionotropic, AMPA 1 (cluster #3 of 4) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIA2-3-E | Glutamate receptor ionotropic, AMPA 2 (cluster #3 of 4) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIA3-3-E | Glutamate receptor ionotropic, AMPA 3 (cluster #3 of 4) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIA4-3-E | Glutamate receptor ionotropic, AMPA 4 (cluster #3 of 5) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIK1-3-E | Glutamate receptor ionotropic kainate 1 (cluster #3 of 3) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIK2-2-E | Glutamate receptor ionotropic kainate 2 (cluster #2 of 3) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIK3-2-E | Glutamate receptor ionotropic kainate 3 (cluster #2 of 3) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIK4-2-E | Glutamate receptor ionotropic kainate 4 (cluster #2 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRIK5-2-E | Glutamate receptor ionotropic kainate 5 (cluster #2 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM1-3-E | Metabotropic glutamate receptor 1 (cluster #3 of 3) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM2-1-E | Metabotropic glutamate receptor 2 (cluster #1 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM3-1-E | Metabotropic glutamate receptor 3 (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM5-4-E | Metabotropic glutamate receptor 5 (cluster #4 of 5) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KAP2-1-E | cAMP-dependent protein kinase type II-alpha regulatory subunit (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KAPCA-1-E | cAMP-dependent protein kinase alpha-catalytic subunit (cluster #1 of 4) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KAPCB-1-E | cAMP-dependent protein kinase beta-1 catalytic subunit (cluster #1 of 3) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| METK1-1-E | S-adenosylmethionine synthetase alpha and beta forms (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| METK2-1-E | S-adenosylmethionine synthetase gamma form (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MMP12-1-E | Macrophage metalloelastase (cluster #1 of 2) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MTAP-1-E | S-methyl-5-thioadenosine phosphorylase (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| OPRM-1-E | Mu-type opioid receptor (cluster #1 of 4) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PNMT-1-E | Phenylethanolamine N-methyltransferase (cluster #1 of 3) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q99MI5-1-E | Spermidine synthase (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SPEE-1-E | Spermidine synthase (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SPSY-1-E | Spermine synthase (cluster #1 of 1) | Eukaryotes | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50597-3-O | Rattus norvegicus (cluster #3 of 5) | Other | 2 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 5NTD-1-E | 5'-nucleotidase (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| 6PGD-1-E | 6-phosphogluconate dehydrogenase (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| A3RLP8-1-V | Thymidine kinase (cluster #1 of 1) | Viruses | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AA3R-6-E | Adenosine receptor A3 (cluster #6 of 6) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACEA-2-F | Isocitrate lyase (cluster #2 of 2) | Fungi | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACES-6-E | Acetylcholinesterase (cluster #6 of 12) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACES-9-E | Acetylcholinesterase (cluster #9 of 12) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACHA4-2-E | Neuronal acetylcholine receptor protein alpha-4 subunit (cluster #2 of 5) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACHA6-3-E | Neuronal acetylcholine receptor subunit alpha-6 (cluster #3 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACHA7-4-E | Neuronal acetylcholine receptor protein alpha-7 subunit (cluster #4 of 6) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACHB3-3-E | Neuronal acetylcholine receptor subunit beta-3 (cluster #3 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ACHB4-7-E | Neuronal acetylcholine receptor subunit beta-4 (cluster #7 of 7) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA1B-1-E | Alpha-1b adrenergic receptor (cluster #1 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA2A-3-E | Alpha-2a adrenergic receptor (cluster #3 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA2B-4-E | Alpha-2b adrenergic receptor (cluster #4 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADA2C-3-E | Alpha-2c adrenergic receptor (cluster #3 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADCY2-2-E | Adenylate cyclase type II (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADCY3-2-E | Adenylate cyclase type III (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADCY4-2-E | Adenylate cyclase type IV (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADCY5-2-E | Adenylate cyclase type V (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADCY6-2-E | Adenylate cyclase type VI (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADCY8-1-E | Adenylate cyclase type VIII (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ADRB1-2-E | Beta-1 adrenergic receptor (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AGAL-1-E | Alpha-galactosidase (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AGALC-1-F | Alpha-galactosidase C (cluster #1 of 1) | Fungi | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AMPM2-2-E | Methionine aminopeptidase 2 (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ANM1-1-E | Protein-arginine N-methyltransferase 1 (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| AROQ-1-B | 3-dehydroquinate dehydratase (cluster #1 of 1) | Bacteria | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| B5SU02-1-E | Alpha carbonic anhydrase (cluster #1 of 6) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CA2D1-1-E | Voltage-gated calcium channel alpha2/delta subunit 1 (cluster #1 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH1-3-E | Carbonic anhydrase I (cluster #3 of 12) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH12-3-E | Carbonic anhydrase XII (cluster #3 of 9) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH13-5-E | Carbonic anhydrase XIII (cluster #5 of 7) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH13-7-E | Carbonic anhydrase XIII (cluster #7 of 7) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH15-1-E | Carbonic anhydrase 15 (cluster #1 of 6) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH2-4-E | Carbonic anhydrase II (cluster #4 of 15) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH2-7-E | Carbonic anhydrase II (cluster #7 of 15) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH3-3-E | Carbonic anhydrase III (cluster #3 of 6) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH4-2-E | Carbonic anhydrase IV (cluster #2 of 16) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH4-8-E | Carbonic anhydrase IV (cluster #8 of 16) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH5A-8-E | Carbonic anhydrase VA (cluster #8 of 10) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH5B-8-E | Carbonic anhydrase VB (cluster #8 of 9) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CAH9-2-E | Carbonic anhydrase IX (cluster #2 of 11) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CASP2-3-E | Caspase-2 (cluster #3 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| CBPA1-1-E | Carboxypeptidase A1 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| D4A3N4-1-E | Brain adenylate cyclase 1 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DAPE-1-B | Succinyl-diaminopimelate desuccinylase (cluster #1 of 1) | Bacteria | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DEF-1-B | Peptide deformylase (cluster #1 of 1) | Bacteria | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DEF1A-1-E | Peptide deformylase 1A, chloroplastic (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DEFM-1-E | Peptide deformylase mitochondrial (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DHAS-1-B | Aspartate-semialdehyde dehydrogenase (cluster #1 of 1) | Bacteria | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DNM3B-1-E | DNA (cytosine-5)-methyltransferase 3B (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DNMT1-1-E | DNA (cytosine-5)-methyltransferase 1 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DRD1-1-E | Dopamine D1 receptor (cluster #1 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DRD2-3-E | Dopamine D2 receptor (cluster #3 of 24) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DRD3-1-E | Dopamine D3 receptor (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DRD4-2-E | Dopamine D4 receptor (cluster #2 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DRD5-1-E | Dopamine D5 receptor (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DXR-2-B | 1-deoxyxylulose-5-phosphate reductoisomerase (cluster #2 of 2) | Bacteria | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DYR-1-E | Dihydrofolate reductase (cluster #1 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| DYR-2-E | Dihydrofolate reductase (cluster #2 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| E1BN64-1-E | Phosphodiesterase 3B (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| EAA3-2-E | Excitatory amino acid transporter 3 (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| ECE1-1-E | Endothelin-converting enzyme 1 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| F16P1-1-E | Fructose-1,6-bisphosphatase 1 (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FAAH1-7-E | Anandamide amidohydrolase (cluster #7 of 7) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FABP4-2-E | Fatty acid binding protein adipocyte (cluster #2 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FABP4-3-E | Fatty acid binding protein adipocyte (cluster #3 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FABP5-2-E | Fatty acid binding protein epidermal (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FABPH-3-E | Fatty acid binding protein muscle (cluster #3 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FABPI-2-E | Fatty acid binding protein intestinal (cluster #2 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FAS-2-E | Fatty acid synthase (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FDFT-3-E | Squalene synthetase (cluster #3 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FNTA-2-F | Protein farnesyltransferase/geranylgeranyltransferase type I alpha subunit (cluster #2 of 2) | Fungi | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FNTB-2-F | Protein farnesyltransferase beta subunit (cluster #2 of 2) | Fungi | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FOLR1-1-E | Folate receptor alpha (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FOLR2-1-E | Folate receptor beta (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FOLR3-1-E | Folate receptor gamma (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| FYN-5-E | Tyrosine-protein kinase FYN (cluster #5 of 5) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GABR1-1-E | GABA-B receptor 1 (cluster #1 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GABR1-2-E | GABA-B receptor 1 (cluster #2 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GABR2-1-E | GABA-B receptor 2 (cluster #1 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GABR2-2-E | GABA-B receptor 2 (cluster #2 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA1-7-E | GABA receptor alpha-1 subunit (cluster #7 of 8) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA2-8-E | GABA receptor alpha-2 subunit (cluster #8 of 8) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA3-8-E | GABA receptor alpha-3 subunit (cluster #8 of 8) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA4-7-E | GABA receptor alpha-4 subunit (cluster #7 of 7) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA5-8-E | GABA receptor alpha-5 subunit (cluster #8 of 8) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRA6-7-E | GABA receptor alpha-6 subunit (cluster #7 of 8) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRB1-6-E | GABA receptor beta-1 subunit (cluster #6 of 6) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRB2-5-E | GABA receptor beta-2 subunit (cluster #5 of 7) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRB3-4-E | GABA receptor beta-3 subunit (cluster #4 of 6) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRD-3-E | GABA receptor delta subunit (cluster #3 of 5) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRE-3-E | GABA receptor epsilon subunit (cluster #3 of 5) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRG1-6-E | GABA receptor gamma-1 subunit (cluster #6 of 7) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRG2-6-E | GABA receptor gamma-2 subunit (cluster #6 of 7) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRG3-7-E | GABA receptor gamma-3 subunit (cluster #7 of 7) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRP-3-E | GABA receptor pi subunit (cluster #3 of 6) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GBRT-5-E | GABA receptor theta subunit (cluster #5 of 5) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GDE-1-E | Glycogen debranching enzyme (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GLRA1-2-E | Glycine receptor subunit alpha-1 (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GLRA2-2-E | Glycine receptor subunit alpha-2 (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GLRA3-2-E | Glycine receptor alpha-3 chain (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GLRA4-2-E | Glycine receptor alpha-4 chain (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GLRB-2-E | Glycine receptor beta chain (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRM8-1-E | Metabotropic glutamate receptor 8 (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GRP78-1-E | 78 kDa glucose-regulated protein (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GYRA-1-B | DNA gyrase subunit A (cluster #1 of 1) | Bacteria | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| GYRB-1-B | DNA gyrase subunit B (cluster #1 of 1) | Bacteria | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HCAR2-2-E | HM74 nicotinic acid GPCR (cluster #2 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HCAR2-3-E | HM74 nicotinic acid GPCR (cluster #3 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HDAC3-3-E | Histone deacetylase 3 (cluster #3 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| HSP7C-1-E | Heat shock cognate 71 kDa protein (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| I23O1-1-E | Indoleamine 2,3-dioxygenase 1 (cluster #1 of 5) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| IMDH1-1-E | Inosine-5'-monophosphate dehydrogenase 1 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| IMDH2-1-E | Inosine-5'-monophosphate dehydrogenase 2 (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| INMT-1-E | Indolethylamine N-methyltransferase (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KITH-1-E | Thymidine kinase (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KITH-1-V | Thymidine kinase (cluster #1 of 1) | Viruses | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| KTHY-1-B | Thymidylate kinase (cluster #1 of 1) | Bacteria | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LCK-4-E | Tyrosine-protein kinase LCK (cluster #4 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LUXS-1-B | S-ribosylhomocysteine lyase (cluster #1 of 1) | Bacteria | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| LYAG-1-E | Alpha-glucosidase (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MAPK2-1-E | MAP kinase-activated protein kinase 2 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MGA-1-E | Maltase-glucoamylase (cluster #1 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MMP1-2-E | Matrix metalloproteinase-1 (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MMP2-1-E | 72 kDa type IV collagenase (cluster #1 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MMP3-1-E | Matrix metalloproteinase 3 (cluster #1 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MMP8-1-E | Matrix metalloproteinase 8 (cluster #1 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MMP9-2-E | Matrix metalloproteinase 9 (cluster #2 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MPIP2-1-E | Dual specificity phosphatase Cdc25B (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MTR1A-2-E | Melatonin receptor 1A (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MTR1B-2-E | Melatonin receptor 1B (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MURA-1-B | UDP-N-acetylglucosamine 1-carboxyvinyltransferase (cluster #1 of 2) | Bacteria | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| MURI-2-B | Glutamate racemase (cluster #2 of 2) | Bacteria | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NEP-2-E | Neprilysin (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NMDE1-4-E | Glutamate [NMDA] receptor subunit epsilon 1 (cluster #4 of 5) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NMDE2-4-E | Glutamate [NMDA] receptor subunit epsilon 2 (cluster #4 of 5) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NMDE3-3-E | Glutamate [NMDA] receptor subunit epsilon 3 (cluster #3 of 4) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NMDE4-2-E | Glutamate [NMDA] receptor subunit epsilon 4 (cluster #2 of 6) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| NOS2-7-E | Nitric oxide synthase, inducible (cluster #7 of 9) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| OGT1-1-E | UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| OPRD-1-E | Delta opioid receptor (cluster #1 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| OPRK-2-E | Kappa opioid receptor (cluster #2 of 6) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| OTC-1-E | Ornithine carbamoyltransferase (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| P2RY1-1-E | Purinergic receptor P2Y1 (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| P2RY6-1-E | Pyrimidinergic receptor P2Y6 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PAO-1-E | Polyamine oxidase (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PDE3A-1-E | Phosphodiesterase 3A (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PDE3B-1-E | Phosphodiesterase 3B (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PEPD-1-E | Xaa-Pro dipeptidase (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PGH2-6-E | Cyclooxygenase-2 (cluster #6 of 8) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PLCB3-1-E | Phospholipase C-beta-3 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PLCG2-1-E | Phospholipase C-gamma-2 (cluster #1 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PNPH-1-E | Purine-nucleoside phosphorylase (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PPR-2-V | Human herpesvirus 2 protease (cluster #2 of 2) | Viruses | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| PYRF-1-F | Orotidine phosphate decarboxylase (cluster #1 of 1) | Fungi | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q5DUH8-1-E | Alpha-galactosidase (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q72547-1-V | Human immunodeficiency virus type 1 reverse transcriptase (cluster #1 of 6) | Viruses | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q72874-1-V | Human immunodeficiency virus type 1 protease (cluster #1 of 3) | Viruses | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q72874-2-V | Human immunodeficiency virus type 1 protease (cluster #2 of 3) | Viruses | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q79MP6-1-B | Beta-lactamase (cluster #1 of 2) | Bacteria | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q7X1P7-1-B | ParE (cluster #1 of 1) | Bacteria | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q7ZJM1-4-V | Human immunodeficiency virus type 1 integrase (cluster #4 of 6) | Viruses | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q81VW8-1-B | Dihydropteroate synthase (cluster #1 of 1) | Bacteria | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q8BGP7-2-E | Neuronal acetylcholine receptor protein beta-2 subunit (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q8CFM9-1-E | Adenylate cyclase type VII (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q9JN24-1-B | Peptide deformylase (cluster #1 of 1) | Bacteria | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Q9WTR4-2-E | Norepinephrine transporter (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| S22A6-2-E | Solute carrier family 22 member 6 (cluster #2 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| S6A11-1-E | GABA transporter 3 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| S6A13-1-E | GABA transporter 3 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SC5A7-1-E | High affinity choline transporter 1 (cluster #1 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SC6A1-2-E | GABA transporter 1 (cluster #2 of 2) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SC6A3-3-E | Dopamine transporter (cluster #3 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SETD7-1-E | Histone-lysine N-methyltransferase SETD7 (cluster #1 of 1) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SGMR1-4-E | Sigma opioid receptor (cluster #4 of 6) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SRC-1-E | Tyrosine-protein kinase SRC (cluster #1 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| SUIS-1-E | Sucrase-isomaltase (cluster #1 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TTHY-2-E | Transthyretin (cluster #2 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TYRO-3-F | Tyrosinase (cluster #3 of 8) | Fungi | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| TYSY-1-E | Thymidylate synthase (cluster #1 of 3) | Eukaryotes | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100250-2-O | Calf thymus DNA (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100273-1-O | P3 purinoceptor (cluster #1 of 1) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z100771-2-O | Mitochondrial complex I (cluster #2 of 2) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z104297-2-O | Glutamate NMDA receptor; GRIN1/GRIN2B (cluster #2 of 3) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z104301-3-O | GABA-A receptor; anion channel (cluster #3 of 8) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z104302-6-O | Glutamate NMDA receptor (cluster #6 of 7) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |
| Z50597-1-O | Rattus norvegicus (cluster #1 of 5) | Other | 1 | Annotations Catalogs | SMILES SDF Mol2 Flexibase |