Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | USP7 | Q93009 | 2/20 | 0.39 |
| ▸ | USP47 | Q96K76 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL58157 | 0.86 | TDP1 (0.65) | TDP1HPGDGPR35ALDH1A1CYP1A2 | |
| SCHEMBL29460277 | 0.86 | TDP1 (0.65) | TDP1HPGDGPR35ALDH1A1CYP1A2 | |
| SCHEMBL28282595 | 0.86 | TDP1 (0.65) | TDP1HPGDGPR35ALDH1A1CYP1A2 | |
| Nitrogen SCHEMBL9816717 | 0.82 | TDP1 (0.61) | TDP1HPGDGPR35ALDH1A1CYP1A2 | |
| Formic Acid SCHEMBL27433484 | 0.77 | TDP1 (0.55) | TDP1HPGDGPR35ALDH1A1CYP2C19 | |
| SCHEMBL27275673 | 0.76 | TDP1 (0.57) | TDP1HPGDGPR35ALDH1A1MEN1 | |
| Nitrobenzene SCHEMBL11650386 | 0.76 | ALDH1A1 (0.57) | TDP1HPGDGPR35ALDH1A1MEN1 | |
| SCHEMBL1460867 | 0.75 | TDP1 (0.61) | TDP1HPGDGPR35ALDH1A1MEN1 | |
| Phenol SCHEMBL28068475 | 0.75 | TDP1 (0.52) | TDP1HPGDGPR35ALDH1A1CYP2C19 | |
| Tetrahydrothiophene SCHEMBL11517766 | 0.73 | MAPK1 (0.73) | TDP1ALDH1A1MEN1KMT2AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-4164517-A | REACTING A CHLORONITROBENZENE WITH POTASSIUM FLUORIDE IN SULFOLANE | I.S.C. CHEMICALS LIMITED (GB) | 1979-08-14 | — | — | US | claimed |
| US-4164517-A | REACTING A CHLORONITROBENZENE WITH POTASSIUM FLUORIDE IN SULFOLANE | I.S.C. CHEMICALS LIMITED (GB) | 1979-08-14 | — | — | US | disclosed |