Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.58 |
| ▸ | CYP11B1 | P15538 | 5/20 | 0.51 |
| ▸ | CYP11B2 | P19099 | 5/20 | 0.51 |
| ▸ | TNF | P01375 | 1/20 | 0.51 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | FDPS | P14324 | 2/20 | 0.48 |
| ▸ | GGPS1 | O95749 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | APAF1 | O14727 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9745498 | 0.83 | TDP1 (0.58) | TDP1CYP11B1CYP11B2TNFEGLN3 | |
| Hydrogen Sulfide SCHEMBL29074168 | 0.80 | TDP1 (0.58) | TDP1CYP11B1CYP11B2TNFEGLN3 | |
| SCHEMBL5884248 | 0.78 | TDP1 (0.59) | TDP1CYP11B1CYP11B2TNFEGLN3 | |
| SCHEMBL326813 | 0.77 | TDP1 (0.63) | TDP1CYP11B1CYP11B2TNFEGLN3 | |
| SCHEMBL2140382 | 0.77 | TDP1 (0.63) | TDP1CYP11B1CYP11B2TNFEGLN3 | |
| SCHEMBL7106613 | 0.77 | TDP1 (0.63) | TDP1CYP11B1CYP11B2TNFEGLN3 | |
| SCHEMBL29958345 | 0.77 | TDP1 (0.63) | TDP1CYP11B1CYP11B2TNFEGLN3 | |
| SCHEMBL7160203 | 0.76 | TDP1 (0.61) | TDP1CYP11B1CYP11B2TNFEGLN3 | |
| Bromide SCHEMBL11005339 | 0.76 | TDP1 (0.61) | TDP1CYP11B1CYP11B2TNFEGLN3 | |
| SCHEMBL9501830 | 0.75 | TDP1 (0.47) | TDP1CYP11B1CYP11B2TNFEGLN3 |
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-114685495-A | N-difluoromethyl dinitrogen heterocyclic selenourea compounds with insecticidal, antibacterial, herbicidal and anticancer effects, and preparation and application thereof | 华南农业大学 | 2022-07-01 | — | — | CN | disclosed |