Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 3/20 | 0.54 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.51 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
| ▸ | AKT1 | P31749 | 2/20 | 0.42 |
| ▸ | AKT2 | P31751 | 2/20 | 0.42 |
| ▸ | AKT3 | Q9Y243 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6175669 | 0.85 | PTGS1 (0.54) | PTGS1PTGS2MAPTNPC1RAB9A | |
| SCHEMBL82549 | 0.84 | PTGS1 (0.62) | PTGS1PTGS2MAPTNPC1RAB9A | |
| SCHEMBL28168647 | 0.82 | GABRA2 (0.45) | PTGS1PTGS2TAAR1GABRA2GABRB2 | |
| SCHEMBL6175631 | 0.82 | PTGS1 (0.55) | PTGS1PTGS2MAPTNPC1RAB9A | |
| SCHEMBL713976 | 0.76 | PTGS1 (0.54) | PTGS1PTGS2MAPTNPC1RAB9A | |
| SCHEMBL30872059 | 0.76 | NPC1 (0.68) | PTGS1PTGS2MAPTNPC1RAB9A | |
| SCHEMBL21113586 | 0.75 | PTGS2 (0.63) | PTGS1PTGS2MAPTLMNASMN1; SMN2 | |
| SCHEMBL948155 | 0.74 | PTGS1 (0.51) | PTGS1PTGS2MAPTNPC1RAB9A | |
| SCHEMBL28111777 | 0.74 | MAPK9 (0.48) | TAAR1AKT1AKT2AKT3NPC1 | |
| SCHEMBL28849204 | 0.74 | PTGS2 (0.43) | PTGS1PTGS2GABRA2GABRB2 |
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-106238098-A | The preparation method of a kind of 1,2,4,5 four substituted ramification of imidazole and catalyst for preparing thereof | 马鞍山市泰博化工科技有限公司 | 2016-12-21 | — | — | CN | disclosed |