Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 7/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.47 |
| ▸ | NPC1 | O15118 | 6/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.46 |
| ▸ | HPGD | P15428 | 5/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL21585782 | 0.85 | ALDH1A1 (0.46) | RAB9AKDM4ENPC1ALDH1A1HPGD | |
| SCHEMBL13850894 | 0.78 | RAB9A (0.47) | RAB9AKDM4ENPC1ALDH1A1HPGD | |
| SCHEMBL3203987 | 0.78 | ALDH1A1 (0.46) | RAB9AKDM4ENPC1ALDH1A1HPGD | |
| SCHEMBL20265295 | 0.78 | RAB9A (0.49) | RAB9AKDM4ENPC1ALDH1A1HPGD | |
| SCHEMBL25343568 | 0.74 | ALDH1A1 (0.50) | RAB9AKDM4ENPC1ALDH1A1HPGD | |
| SCHEMBL25344717 | 0.74 | RAB9A (0.45) | RAB9AKDM4ENPC1ALDH1A1HPGD | |
| SCHEMBL30926481 | 0.72 | RAB9A (0.49) | RAB9AKDM4ENPC1ALDH1A1HPGD | |
| SCHEMBL2315523 | 0.72 | RAB9A (0.48) | RAB9AKDM4ENPC1ALDH1A1HPGD | |
| SCHEMBL5069717 | 0.71 | ALDH1A1 (0.71) | RAB9AKDM4ENPC1ALDH1A1HPGD | |
| SCHEMBL31329788 | 0.71 | RAB9A (0.45) | RAB9AKDM4ENPC1ALDH1A1HPGD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3802539-B1 | TETRAHYDRO-1H-PYRAZINO[2,1-A]ISOINDOLYLQUINOLINE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASE | HOFFMANN LA ROCHE (CH) | 2023-09-20 | — | — | EP | disclosed |
| WO-2019233941-A1 | TETRAHYDRO-1 H-PYRAZINO[2,1 -AJISOINDOLYLQUINOLINE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASE | F. HOFFMANN-LA ROCHE AG (CH) | 2019-12-12 | — | — | WO | disclosed |