Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 2/20 | 0.39 |
| ▸ | PDE2A | O00408 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | USP2 | O75604 | 2/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | PDE1C | Q14123 | 4/20 | 0.36 |
| ▸ | PDE9A | O76083 | 3/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.33 |
| ▸ | PDE5A | O76074 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL6051956 | 0.85 | PDE2A (0.43) | PDE2AHPGDALDH1A1TSHRUSP2 | |
| SCHEMBL6051984 | 0.78 | HPGD (0.42) | PDE2AHPGDALDH1A1TSHRUSP2 | |
| SCHEMBL7440938 | 0.78 | HPGD (0.44) | PDE2AHPGDALDH1A1TSHRUSP2 | |
| SCHEMBL7435951 | 0.76 | PDE2A (0.46) | PDE2AHPGDALDH1A1PDE1CKDM4E | |
| SCHEMBL6051959 | 0.76 | PDE2A (0.63) | PDE2AKMT2APDE1CPDE9AKDM4E | |
| SCHEMBL6052100 | 0.74 | PDE2A (0.44) | PDE2AHPGDALDH1A1PDE1CKDM4E | |
| SCHEMBL7433401 | 0.74 | ALDH1A1 (0.40) | ADORA1PDE2AHPGDALDH1A1TSHR | |
| SCHEMBL7436563 | 0.73 | PDE2A (0.57) | PDE2AKMT2ACDK1 | |
| SCHEMBL7436566 | 0.73 | PDE2A (0.45) | PDE2AKDM4E | |
| SCHEMBL7445158 | 0.72 | ALDH1A1 (0.40) | ADORA1PDE2AHPGDALDH1A1TSHR |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5861404-A | ANTIINFLAMMATORY AGENTS, THROMBOEMBOLIC AND CARDIOVASCULAR DISORDERS | BAYER AKTIENGESELLSCHAFT (DE) | 1999-01-19 | — | — | US | claimed |