Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CDK2 | P24941 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | THPO | P40225 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL2572414 | 0.80 | ADH1B (0.52) | MEN1KMT2AALDH1A1HPGDPOLB | |
| SCHEMBL2572416 | 0.80 | ADH1B (0.52) | MEN1KMT2AALDH1A1HPGDPOLB | |
| SCHEMBL2578583 | 0.80 | ADH1B (0.52) | MEN1KMT2AALDH1A1HPGDPOLB | |
| SCHEMBL27717421 | 0.77 | IDO1 (0.41) | SIGMAR1MEN1KMT2AALDH1A1POLB | |
| Benzene SCHEMBL28155566 | 0.76 | ADH1B (0.42) | MEN1KMT2AALDH1A1POLBL3MBTL1 | |
| SCHEMBL6014354 | 0.75 | SIGMAR1 (0.57) | SIGMAR1MEN1KMT2AHPGDPOLB | |
| SCHEMBL825002 | 0.75 | FBP1 (0.44) | SIGMAR1MEN1KMT2AALDH1A1NPC1 | |
| SCHEMBL28156405 | 0.74 | FBP1 (0.46) | MEN1KMT2AALDH1A1HPGDNPC1 | |
| SCHEMBL20592079 | 0.74 | SIGMAR1 (0.55) | SIGMAR1MEN1KMT2AALDH1A1HPGD | |
| SCHEMBL1356645 | 0.73 | SIGMAR1 (0.65) | SIGMAR1MEN1KMT2AL3MBTL1 |
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-106831532-A | Full substitution 3 nitroindoline compounds and its midbody compound, preparation method and application | 云南大学 | 2017-06-13 | — | — | CN | disclosed |