Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | CHEK2 | O96017 | 8/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.43 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.43 |
| ▸ | IKBKB | O14920 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | MMP9 | P14780 | 1/20 | 0.39 |
| ▸ | MMP8 | P22894 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 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 | |
|---|---|---|---|---|
| SCHEMBL18458312 | 0.84 | CHEK2 (0.46) | MAPTMEN1USP2ALOX15KMT2A | |
| SCHEMBL11539387 | 0.79 | MAPT (0.59) | MAPTMEN1USP2KMT2AHSD17B10 | |
| SCHEMBL28211106 | 0.79 | ERN1 (0.41) | MAPTKMT2AADORA3ADORA2AADORA2B | |
| SCHEMBL12670300 | 0.77 | SMN1; SMN2 (0.59) | MAPTCHEK2ADORA3ADORA2AADORA2B | |
| SCHEMBL18458070 | 0.73 | IDH2 (0.53) | MEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL10740176 | 0.72 | ATM (0.49) | MAPTMEN1USP2KMT2AHSD17B10 | |
| SCHEMBL18458314 | 0.72 | KCNH2 (0.41) | MAPTMEN1USP2ALOX15KMT2A | |
| SCHEMBL692248 | 0.71 | IMPDH2 (0.54) | MAPTMEN1USP2ALOX15KMT2A | |
| SCHEMBL4876161 | 0.70 | — | — | |
| SCHEMBL34467254 | 0.70 | KCNH2 (0.57) | MAPTMEN1USP2ALOX15KMT2A |
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-107922375-A | Target the antitumoral compounds and its application method of IDH2 mutation | 正大天晴药业集团股份有限公司 | 2018-04-17 | — | — | CN | disclosed |