Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 3/20 | 0.51 |
| ▸ | RAB9A | P51151 | 4/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | MGAM | O43451 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.41 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.41 |
| ▸ | RELA | Q04206 | 2/20 | 0.41 |
| ▸ | PRNP | P04156 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.40 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.40 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL16158216 | 0.82 | CNR2 (0.50) | CNR2RAB9ANPC1MGAMKDM4E | |
| SCHEMBL6543474 | 0.72 | NCF1 (0.48) | RAB9ANPC1MGAMKDM4ESMN1; SMN2 | |
| SCHEMBL31665931 | 0.70 | NCF1 (0.46) | CNR2RAB9ANPC1MGAMKDM4E | |
| SCHEMBL3294200 | 0.70 | NCF1 (0.46) | CNR2RAB9ANPC1MGAMKDM4E | |
| SCHEMBL28623257 | 0.70 | MGAM (0.47) | CNR2RAB9ANPC1MGAMKDM4E | |
| SCHEMBL30771873 | 0.70 | MGAM (0.47) | CNR2RAB9ANPC1MGAMKDM4E | |
| SCHEMBL25421647 | 0.69 | MGAM (0.46) | CNR2RAB9ANPC1MGAMKDM4E | |
| SCHEMBL28259834 | 0.69 | CYP1A2 (0.50) | RAB9ANPC1MGAMKDM4ESMN1; SMN2 | |
| SCHEMBL30227109 | 0.68 | CNR2 (1.00) | CNR2RAB9ANPC1MGAMKDM4E | |
| SCHEMBL7832199 | 0.68 | CNR2 (1.00) | CNR2RAB9ANPC1MGAMKDM4E |
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-111116475-A | Synthesis method of α dibromide of α -heterocyclic carbonyl compound | 中国药科大学 | 2020-05-08 | — | — | CN | disclosed |