Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.54 |
| ▸ | NPC1 | O15118 | 3/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | SIRT2 | Q8IXJ6 | 2/20 | 0.46 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.43 |
| ▸ | ELANE | P08246 | 1/20 | 0.43 |
| ▸ | BCL2 | P10415 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | CDK4 | P11802 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28006725 | 0.88 | MEN1 (0.52) | RAB9ANPC1MAPTAMY1AHTT | |
| SCHEMBL28006438 | 0.83 | ELANE (0.48) | RAB9ANPC1MAPTHTTALDH1A1 | |
| SCHEMBL28006734 | 0.83 | CDK4 (0.59) | RAB9ANPC1MAPTKDM4EMEN1 | |
| SCHEMBL28006432 | 0.83 | SIRT2 (0.58) | MAPTSIRT2SIRT1CDK4CDK6 | |
| SCHEMBL28006730 | 0.82 | CDK4 (0.58) | MAPTKDM4ESIRT2SIRT1CDK4 | |
| SCHEMBL28006726 | 0.82 | SIRT2 (0.50) | RAB9ANPC1MAPTHTTSIRT2 | |
| SCHEMBL28006733 | 0.82 | SIRT2 (0.53) | HPGDSIRT2SIRT1CDK4CDK6 | |
| SCHEMBL28006403 | 0.80 | CDK4 (0.60) | MAPTALDH1A1HPGDSMN1; SMN2KDM4E | |
| SCHEMBL28006405 | 0.80 | CDK4 (0.60) | MAPTALDH1A1HPGDSMN1; SMN2KDM4E | |
| SCHEMBL28818035 | 0.76 | CDK4 (0.55) | RAB9ANPC1MAPTALDH1A1MEN1 |
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-104496970-A | 3,4-bi(3-indole)-2,5-dione-3-pyrrolineimine compound, preparation method of compound and application of compound in anti-cancer drug | UNIV HENAN NORMAL | 2015-04-08 | — | — | CN | disclosed |