Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR3 | P46089 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 8/20 | 0.39 |
| ▸ | HPGD | P15428 | 5/20 | 0.39 |
| ▸ | RAB9A | P51151 | 4/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 4/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.34 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL25165146 | 0.81 | GPR3 (0.45) | GPR3MAPTHPGDRAB9ANPC1 | |
| SCHEMBL18767342 | 0.78 | KDM4E (0.38) | GPR3MAPTHPGDRAB9ANPC1 | |
| SCHEMBL19961740 | 0.76 | PARP14 (0.46) | GPR3MAPTL3MBTL1MAPK1TUBB4A | |
| SCHEMBL31672181 | 0.74 | CYP2A6 (0.48) | GPR3MAPTHPGDRAB9ANPC1 | |
| SCHEMBL9526065 | 0.74 | CYP2A6 (0.48) | GPR3MAPTHPGDRAB9ANPC1 | |
| SCHEMBL3052012 | 0.74 | GPR3 (0.48) | GPR3MAPTHPGDRAB9ANPC1 | |
| SCHEMBL24275425 | 0.72 | KDM4E (0.38) | GPR3MAPTHPGDRAB9ANPC1 | |
| SCHEMBL3698431 | 0.72 | CHAT (0.50) | — | |
| SCHEMBL25029526 | 0.71 | TUBB4A (0.56) | MAPTALDH1A1KDM4ETDP1MEN1 | |
| SCHEMBL4961400 | 0.71 | GPR3 (0.54) | GPR3MAPTHPGDRAB9ANPC1 |
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-112638895-A | Organic compound containing chalcogen element, organic semiconductor material, organic semiconductor film, and organic electric field effect transistor | 国立大学法人东京大学 | 2021-04-09 | — | — | CN | disclosed |