Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 4/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | PTPRC | P08575 | 1/20 | 0.40 |
| ▸ | S100A4 | P26447 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL19336225 | 0.93 | POLB (0.52) | POLBHTTTDP1ALDH1A1CYP3A4 | |
| SCHEMBL260864 | 0.90 | CYP1A2 (0.47) | POLBHTTTDP1ALDH1A1CYP3A4 | |
| SCHEMBL29368452 | 0.90 | CYP1A2 (0.47) | POLBHTTTDP1ALDH1A1CYP3A4 | |
| SCHEMBL7566464 | 0.88 | POLB (0.59) | POLBHTTTDP1ALDH1A1CYP3A4 | |
| SCHEMBL18331626 | 0.84 | CYP1A2 (0.42) | POLBHTTTDP1ALDH1A1CYP3A4 | |
| SCHEMBL13248046 | 0.82 | POLB (0.49) | POLBHTTTDP1ALDH1A1CYP3A4 | |
| SCHEMBL695556 | 0.81 | ALDH1A1 (0.61) | TDP1ALDH1A1CYP3A4TSHRCYP1A2 | |
| SCHEMBL30933154 | 0.81 | ALDH1A1 (0.61) | TDP1ALDH1A1CYP3A4TSHRCYP1A2 | |
| SCHEMBL30780892 | 0.81 | ALDH1A1 (0.60) | POLBHTTTDP1ALDH1A1CYP3A4 | |
| SCHEMBL694999 | 0.81 | ALDH1A1 (0.60) | POLBHTTTDP1ALDH1A1CYP3A4 |
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-106164041-B | The manufacture method of nitro compound | 住友化学株式会社 | 2018-05-04 | — | — | CN | disclosed |