Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.56 |
| ▸ | MAOB | P27338 | 6/20 | 0.42 |
| ▸ | MAOA | P21397 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.40 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.40 |
| ▸ | TACR2 | P21452 | 1/20 | 0.39 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.38 |
| ▸ | CDK1 | P06493 | 1/20 | 0.38 |
| ▸ | CDK4 | P11802 | 1/20 | 0.38 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.38 |
| ▸ | CCND1 | P24385 | 1/20 | 0.38 |
| ▸ | CCNB3 | Q8WWL7 | 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 | |
|---|---|---|---|---|
| SCHEMBL16892215 | 0.86 | TDP1 (0.57) | TDP1KMT2AL3MBTL1MAOBMAOA | |
| SCHEMBL10522223 | 0.84 | MAOB (0.53) | TDP1KMT2AL3MBTL1MAOBMAOA | |
| SCHEMBL16892197 | 0.78 | ALDH1A1 (0.44) | TDP1KMT2AL3MBTL1ALDH1A1HSD17B10 | |
| SCHEMBL16892161 | 0.73 | RAB9A (0.68) | TDP1KMT2AL3MBTL1MAOBMAOA | |
| SCHEMBL16892159 | 0.73 | MAOB (0.50) | MAOBMAOA | |
| SCHEMBL13534203 | 0.72 | AOC3 (0.54) | KMT2AALDH1A1RAB9AHTR1ANPC1 | |
| SCHEMBL11039239 | 0.72 | HTR1A (0.41) | TDP1KMT2AL3MBTL1ALDH1A1HTR1A | |
| SCHEMBL955696 | 0.72 | TDP1 (0.42) | TDP1KMT2AL3MBTL1MAOBALDH1A1 | |
| SCHEMBL1299344 | 0.72 | KMT2A (1.00) | TDP1KMT2AL3MBTL1MAOBMAOA | |
| SCHEMBL16892157 | 0.72 | SPHK2 (0.49) | TDP1KMT2AL3MBTL1HTR1AMTNR1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015101294-A1 | COMPOUNDS WITH ANALGESIC ACTIVITY AND MEDICAL USE THEREOF | 中国人民解放军军事医学科学院毒物药物研究所 | 2015-07-09 | — | — | WO | disclosed |