Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F3 | P13726 | 3/20 | 0.60 |
| ▸ | MAPT | P10636 | 5/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.54 |
| ▸ | APEX1 | P27695 | 1/20 | 0.54 |
| ▸ | BLM | P54132 | 1/20 | 0.54 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | THRB | P10828 | 1/20 | 0.54 |
| ▸ | ATM | Q13315 | 1/20 | 0.54 |
| ▸ | MAOB | P27338 | 4/20 | 0.54 |
| ▸ | MAOA | P21397 | 3/20 | 0.54 |
| ▸ | XDH | P47989 | 2/20 | 0.54 |
| ▸ | P4HB | P07237 | 1/20 | 0.54 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL11196194 | 1.00 | F3 (0.60) | F3MAPTALDH1A1CYP3A4KDM4E | |
| SCHEMBL7896809 | 0.91 | CES2 (0.59) | MAPTALDH1A1CYP3A4KDM4ECYP1A2 | |
| SCHEMBL25954596 | 0.82 | F3 (0.68) | F3MAPTALDH1A1CYP3A4HPGD | |
| SCHEMBL10926361 | 0.81 | F3 (0.54) | F3MAPTALDH1A1CYP3A4KDM4E | |
| SCHEMBL5692873 | 0.80 | XDH (0.78) | F3MAPTALDH1A1CYP3A4KDM4E | |
| SCHEMBL12243319 | 0.80 | F3 (0.66) | F3MAPTALDH1A1CYP3A4KDM4E | |
| SCHEMBL5692868 | 0.80 | XDH (0.78) | F3MAPTALDH1A1CYP3A4KDM4E | |
| SCHEMBL14336693 | 0.80 | F3 (0.66) | F3MAPTALDH1A1CYP3A4KDM4E | |
| SCHEMBL10921923 | 0.79 | F3 (0.66) | F3MAPTALDH1A1CYP3A4KDM4E | |
| Cyanide SCHEMBL11196198 | 0.79 | XDH (0.71) | F3MAPTALDH1A1CYP3A4KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-4371606-A | 2-(Halogenomethyl-phenyl)-4-halogeno-oxaxole derivatives, a process for the preparation thereof, and radiation-sensitive compositions containing these derivatives | HOECHST AKTIENGESELLSCHAFT (DE) | 1983-02-01 | — | — | US | disclosed |