Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FYN | P06241 | 1/20 | 0.52 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.51 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 3/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.46 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.46 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.46 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.46 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.46 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.46 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.45 |
| ▸ | PRKCG | P05129 | 1/20 | 0.45 |
| ▸ | PRKCB | P05771 | 1/20 | 0.45 |
| ▸ | LCK | P06239 | 1/20 | 0.45 |
| ▸ | PRKCA | P17252 | 1/20 | 0.45 |
| ▸ | PRKCH | P24723 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL5457794 | 0.85 | POLB (0.55) | FYNPOLBMAPK1HTTCYP11B1 | |
| SCHEMBL16026628 | 0.83 | PTGS2 (0.62) | PTGS2CYP2A6HTTCYP11B1CYP11B2 | |
| SCHEMBL30199921 | 0.82 | CYP2A6 (0.61) | PTGS2CYP2A6POLBMAPK1HTT | |
| SCHEMBL4881988 | 0.82 | CYP2A6 (0.61) | PTGS2CYP2A6POLBMAPK1HTT | |
| Ethane SCHEMBL28235431 | 0.82 | PTGS2 (0.65) | PTGS2CYP2A6HTTCYP11B1CYP11B2 | |
| SCHEMBL30032 | 0.82 | PTGS2 (0.64) | PTGS2CYP2A6HTTCYP11B1CYP11B2 | |
| SCHEMBL28181896 | 0.82 | PTGS2 (0.64) | PTGS2CYP2A6HTTCYP11B1CYP11B2 | |
| SCHEMBL31635952 | 0.82 | PTGS2 (0.64) | PTGS2CYP2A6HTTCYP11B1CYP11B2 | |
| SCHEMBL28395310 | 0.81 | POLB (0.51) | FYNPOLBMAPK1HTTCYP11B1 | |
| SCHEMBL12498499 | 0.81 | CYP2A6 (0.51) | CYP2A6POLBMAPK1HTTCYP11B1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113563389-B | Tri-pyridyl cobalt organic complex, tri-pyridyl cobalt organic supramolecular hydrogel, and preparation method and application thereof | 中南大学 | 2022-03-29 | — | — | CN | disclosed |
| CN-113563389-A | Tri-pyridyl cobalt organic complex, tri-pyridyl cobalt organic supramolecular hydrogel, and preparation method and application thereof | 中南大学 | 2021-10-29 | — | — | CN | disclosed |