Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 1/20 | 0.34 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.31 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.31 |
| ▸ | GMNN | O75496 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | MMP2 | P08253 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | MMP9 | P14780 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | MMP8 | P22894 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL31001732 | 0.98 | — | — | |
| SCHEMBL2439123 | 0.98 | — | — | |
| Hydrochloric Acid SCHEMBL28075122 | 0.95 | PDE3B (0.34) | PDE3BPDE3ALMNAKDM4EMAPT | |
| Hydrochloric Acid SCHEMBL28108450 | 0.93 | PDE3B (0.33) | PDE3BPDE3ALMNAKDM4EMAPT | |
| Hydrochloric Acid SCHEMBL28102530 | 0.79 | PDE3B (0.33) | PDE3BPDE3A | |
| Tert-Butyl Formate SCHEMBL28081848 | 0.78 | TDP1 (0.39) | TDP1 | |
| SCHEMBL4769982 | 0.76 | CYP19A1 (0.33) | PDE3BPDE3ALMNAKDM4EMAPT | |
| SCHEMBL1020681 | 0.71 | TDP2 (0.41) | PDE3BPDE3AKDM4ETDP1GAA | |
| SCHEMBL2501190 | 0.70 | PDE3B (0.33) | PDE3BPDE3A | |
| SCHEMBL7074142 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-107778495-A | A kind of cadmium metal organic frame complex and preparation method thereof | 宁波大学 | 2018-03-09 | — | — | CN | disclosed |