Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | TSHR | P16473 | 4/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CA5A | P35218 | 1/20 | 0.35 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | GALR3 | O60755 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11106538 | 0.97 | — | — | |
| SCHEMBL11405882 | 0.93 | ALDH1A1 (0.47) | ALDH1A1TSHRTDP1CA5ACA5B | |
| SCHEMBL11405885 | 0.93 | ALDH1A1 (0.47) | ALDH1A1TSHRTDP1CA5ACA5B | |
| SCHEMBL10897965 | 0.79 | — | — | |
| SCHEMBL6343599 | 0.73 | — | — | |
| SCHEMBL8605702 | 0.73 | — | — | |
| Tert-Butanol SCHEMBL16177522 | 0.72 | — | — | |
| Tert-Butanol SCHEMBL28327309 | 0.72 | ALDH1A1 (0.44) | ALDH1A1TSHRTDP1CA5ACA5B | |
| SCHEMBL1330527 | 0.70 | — | — | |
| SCHEMBL28457846 | 0.70 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110790719-B | Fluorine dinitro ethylamino bifurazan compound and synthetic method thereof | 南京理工大学 | 2022-10-14 | — | — | CN | disclosed |
| CN-110790719-B | Fluorine dinitro ethylamino bifurazan compound and synthetic method thereof | 南京理工大学 | 2022-10-14 | — | — | CN | disclosed |
| CN-113045584-A | Fluorine dinitroethoxy furazapyrazine compound and synthetic method thereof | 南京理工大学 | 2021-06-29 | — | — | CN | disclosed |
| CN-110790719-A | Fluorine dinitro ethylamino bifurazan compound and synthetic method thereof | 南京理工大学 | 2020-02-14 | — | — | CN | disclosed |