Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A2 | P43354 | 1/20 | 0.45 |
| ▸ | JAK2 | O60674 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | IMPDH2 | P12268 | 2/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.38 |
| ▸ | PIM1 | P11309 | 2/20 | 0.38 |
| ▸ | PIM3 | Q86V86 | 2/20 | 0.38 |
| ▸ | ICMT | O60725 | 1/20 | 0.37 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.37 |
| ▸ | CDK4 | P11802 | 1/20 | 0.37 |
| ▸ | CCND1 | P24385 | 1/20 | 0.37 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.35 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.34 |
| ▸ | CLK1 | P49759 | 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 | |
|---|---|---|---|---|
| SCHEMBL28616115 | 0.79 | IMPDH2 (0.53) | IMPDH2IMPDH1ALDH1A1 | |
| SCHEMBL28631910 | 0.76 | CSNK2A1 (0.54) | NR4A2PIM1CLK1GSK3BCDK5 | |
| SCHEMBL188007 | 0.76 | IMPDH2 (0.61) | NR4A2JAK2NPC1IMPDH2MCL1 | |
| SCHEMBL28627511 | 0.76 | SLC6A4 (0.46) | IMPDH2IMPDH1 | |
| SCHEMBL28616802 | 0.73 | GPR84 (0.53) | NR4A2KDM4EALDH1A1 | |
| SCHEMBL6574193 | 0.73 | CSNK2A1 (0.61) | NR4A2ICMTSCN9ACNR2 | |
| SCHEMBL24022684 | 0.72 | IMPDH2 (0.61) | NR4A2JAK2NPC1IMPDH2PIM1 | |
| SCHEMBL18552198 | 0.72 | IMPDH2 (0.61) | NR4A2JAK2NPC1IMPDH2PIM1 | |
| SCHEMBL18552149 | 0.72 | IMPDH2 (0.61) | NR4A2JAK2NPC1IMPDH2PIM1 | |
| SCHEMBL6221010 | 0.70 | ATM (0.57) | NR4A2JAK2NPC1IMPDH2PIM1 |
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-109232363-B | Synthetic method of 3-selenocyanoindole compound | 安徽理工大学 | 2021-08-13 | — | — | CN | disclosed |