Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 5/20 | 0.37 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | DGAT1 | O75907 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 4/20 | 0.34 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.32 |
| ▸ | RELA | Q04206 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16396084 | 0.84 | IDO1 (0.41) | IDO1MAPTDGAT1LMNANPC1 | |
| SCHEMBL3081062 | 0.82 | KDM4E (0.39) | IDO1MAPTDGAT1LMNAKDM4E | |
| SCHEMBL29210472 | 0.82 | IDO1 (0.37) | IDO1MAPTDGAT1LMNANPC1 | |
| SCHEMBL4182056 | 0.82 | ADORA3 (0.37) | IDO1MAPTDGAT1KDM4EKMT2A | |
| SCHEMBL17035507 | 0.80 | IDO1 (0.37) | IDO1MAPTDGAT1LMNANPC1 | |
| SCHEMBL29210490 | 0.79 | IDO1 (0.35) | IDO1MAPTDGAT1LMNANPC1 | |
| SCHEMBL7950529 | 0.79 | MAPT (0.35) | MAPTDGAT1NPC1 | |
| SCHEMBL25438538 | 0.78 | MAPT (0.34) | MAPTDGAT1NPC1RAB9AKDM4E | |
| SCHEMBL1857284 | 0.76 | DGAT1 (0.36) | IDO1MAPTDGAT1NPC1RAB9A | |
| SCHEMBL12777661 | 0.76 | MAPT (0.40) | MAPTNPC1KDM4EPOLBHSD17B10 |
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-117986264-A | Benzo nitrogen-containing polycyclic derivative regulator and preparation method and application thereof | 江苏豪森药业集团有限公司 | 2024-05-07 | — | — | CN | disclosed |