Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | RAB9A | P51151 | 3/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | EGFR | P00533 | 1/20 | 0.46 |
| ▸ | MMP1 | P03956 | 1/20 | 0.46 |
| ▸ | MMP2 | P08253 | 1/20 | 0.46 |
| ▸ | MMP9 | P14780 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | PDK1 | Q15118 | 3/20 | 0.45 |
| ▸ | PDK2 | Q15119 | 3/20 | 0.45 |
| ▸ | PDK3 | Q15120 | 3/20 | 0.45 |
| ▸ | PDK4 | Q16654 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL2175829 | 0.86 | CYP1A2 (0.75) | CYP1A2KDM4ERAB9AMAPK1HPGD | |
| SCHEMBL29537172 | 0.86 | CYP1A2 (0.75) | CYP1A2KDM4ERAB9AMAPK1HPGD | |
| Cyclopropane SCHEMBL29022116 | 0.80 | CYP1A2 (0.68) | CYP1A2KDM4ERAB9AHPGDCYP2C19 | |
| 1,2-Dichlorobenzene SCHEMBL28124693 | 0.75 | TSHR (0.53) | RAB9AMAPK1HPGDMEN1KMT2A | |
| SCHEMBL560265 | 0.75 | CYP1A2 (0.55) | CYP1A2RAB9AMAPK1HPGDCYP2C19 | |
| SCHEMBL8334831 | 0.74 | KDM4E (0.69) | CYP1A2KDM4EMAPK1HPGDCYP2C19 | |
| SCHEMBL29840068 | 0.73 | GAA (0.67) | CYP1A2KDM4ERAB9AMAPK1HPGD | |
| SCHEMBL2068768 | 0.73 | LMNA (0.68) | CYP1A2KDM4ERAB9AMAPK1HPGD | |
| SCHEMBL3928666 | 0.73 | GAA (0.67) | CYP1A2KDM4ERAB9AMAPK1HPGD | |
| SCHEMBL646296 | 0.72 | HPGD (0.66) | CYP1A2KDM4ERAB9AMAPK1HPGD |
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-RE31550-E | N-(2-Chloro-4-pyridyl) ureas | Shudo, Koichi (JP) | 1984-04-10 | — | — | US | disclosed |