Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FBP1 | P09467 | 1/20 | 0.59 |
| ▸ | NFE2L2 | Q16236 | 4/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | MAPT | P10636 | 2/20 | 0.56 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.54 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.52 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.52 |
| ▸ | MAOA | P21397 | 1/20 | 0.52 |
| ▸ | COMT | P21964 | 1/20 | 0.52 |
| ▸ | RELA | Q04206 | 1/20 | 0.51 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | NQO2 | P16083 | 1/20 | 0.48 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.47 |
| ▸ | TUBB | P07437 | 1/20 | 0.47 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.47 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.47 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL28036177 | 0.86 | FBP1 (0.59) | FBP1NFE2L2ALDH1A1LMNAMAPT | |
| SCHEMBL27969970 | 0.85 | NFE2L2 (0.57) | FBP1NFE2L2ALDH1A1LMNAMAPT | |
| SCHEMBL1405379 | 0.84 | NFE2L2 (0.81) | FBP1NFE2L2ALDH1A1LMNAMAPT | |
| SCHEMBL1405381 | 0.84 | NFE2L2 (0.81) | FBP1NFE2L2ALDH1A1LMNAMAPT | |
| SCHEMBL1405454 | 0.83 | PTGS2 (0.75) | FBP1NFE2L2ALDH1A1LMNAMAPT | |
| SCHEMBL1405456 | 0.83 | PTGS2 (0.75) | FBP1NFE2L2ALDH1A1LMNAMAPT | |
| SCHEMBL7918792 | 0.79 | NFE2L2 (0.62) | FBP1NFE2L2ALDH1A1LMNAMAPT | |
| SCHEMBL7918794 | 0.79 | NFE2L2 (0.62) | FBP1NFE2L2ALDH1A1LMNAMAPT | |
| SCHEMBL14392262 | 0.77 | FBP1 (0.58) | FBP1NFE2L2ALDH1A1LMNAMAPT | |
| SCHEMBL28036538 | 0.77 | FBP1 (0.57) | FBP1NFE2L2ALDH1A1LMNAMAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105037165-A | 1, 3-di (2-bromo-5-methoxystyryl) -2, 4, 6-trinitrobenzene compound and preparation method thereof | JIANGSU XINHUAIHE MEDICINE SCIENCE & TECHNOLOGY CO LTD | 2015-11-11 | — | — | CN | claimed |
| CN-105037165-B | 1, 3-di (2-bromo-5-methoxystyryl) -2, 4, 6-trinitrobenzene compound and preparation method thereof | 江苏新淮河医药科技有限公司 | 2017-03-29 | — | — | CN | disclosed |
| CN-105037165-A | 1, 3-di (2-bromo-5-methoxystyryl) -2, 4, 6-trinitrobenzene compound and preparation method thereof | JIANGSU XINHUAIHE MEDICINE SCIENCE & TECHNOLOGY CO LTD | 2015-11-11 | — | — | CN | disclosed |