Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.48 |
| ▸ | FYN | P06241 | 1/20 | 0.48 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.47 |
| ▸ | PRKCI | P41743 | 1/20 | 0.47 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.44 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.44 |
| ▸ | GSK3B | P49841 | 2/20 | 0.43 |
| ▸ | HTR6 | P50406 | 1/20 | 0.43 |
| ▸ | CYP11B1 | P15538 | 4/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.42 |
| ▸ | CYP17A1 | P05093 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | KDR | P35968 | 1/20 | 0.42 |
| ▸ | GRK2 | P25098 | 1/20 | 0.42 |
| ▸ | LTA4H | P09960 | 1/20 | 0.41 |
| ▸ | PRKACA | P17612 | 1/20 | 0.41 |
| ▸ | CDK8 | P49336 | 1/20 | 0.41 |
| ▸ | CLK2 | P49760 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL30008835 | 0.98 | FYN (0.47) | NOTUMFYNPRMT6PRKCIS1PR1 | |
| SCHEMBL28133235 | 0.83 | CYP17A1 (0.42) | FYNPRMT6PRKCICYP11B1CYP11B2 | |
| SCHEMBL28135607 | 0.82 | L3MBTL1 (0.42) | FYNS1PR1GSK3B | |
| Hydrochloric Acid SCHEMBL28477394 | 0.81 | CYP17A1 (0.41) | FYNPRMT6PRKCICYP11B1CYP11B2 | |
| SCHEMBL28486374 | 0.81 | CYP17A1 (0.48) | GSK3BCYP11B1CYP11B2CYP17A1CYP3A4 | |
| Hydrochloric Acid SCHEMBL28404833 | 0.80 | CYP17A1 (0.47) | GSK3BCYP11B1CYP11B2CYP17A1CYP3A4 | |
| SCHEMBL28488403 | 0.79 | CYP17A1 (0.40) | FYNPRMT6PRKCICYP11B1CYP11B2 | |
| SCHEMBL20197185 | 0.78 | CCNC (0.43) | FYNGSK3BLTA4HCDK8GSK3A | |
| SCHEMBL5115091 | 0.74 | RECQL (0.50) | FYNPRKCI | |
| SCHEMBL13562418 | 0.74 | NOS2 (0.53) | — |
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-110642778-B | Viologen compound, preparation method and application thereof | 淮阴师范学院 | 2022-10-04 | — | — | CN | disclosed |
| CN-108474988-A | Electrochromic compositions and use its electrochromic device | 伊格拉斯科技有限公司 | 2018-08-31 | — | — | CN | disclosed |