Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | KYAT1 | Q16773 | 1/20 | 0.35 |
| ▸ | KYAT3 | Q6YP21 | 1/20 | 0.35 |
| ▸ | AADAT | Q8N5Z0 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ERN1 | O75460 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11803025 | 0.74 | ALDH1A1 (0.39) | BRD4NFKB1NFKB2RELATSHR | |
| SCHEMBL21434622 | 0.70 | KYAT1 (0.42) | PTPN1TSHRKYAT1KYAT3AADAT | |
| SCHEMBL28344074 | 0.66 | BRD4 (0.45) | BRD4NFKB1NFKB2RELANPC1 | |
| SCHEMBL15617545 | 0.66 | BRD4 (0.42) | BRD4NFKB1NFKB2RELATSHR | |
| SCHEMBL7346679 | 0.63 | NFKB1 (0.40) | BRD4NFKB1NFKB2RELATSHR | |
| SCHEMBL14037484 | 0.63 | SNCA (0.40) | BRD4NFKB1NFKB2RELAPTPN1 | |
| SCHEMBL1352936 | 0.62 | NOTUM (0.44) | TSHRNPC1RAB9ANOTUMALDH1A1 | |
| SCHEMBL15617600 | 0.62 | NFKB1 (0.43) | NFKB1NFKB2RELATSHRNPC1 | |
| SCHEMBL3698883 | 0.62 | CA12 (0.37) | BRD4TSHRGAANOTUMALDH1A1 | |
| SCHEMBL8884488 | 0.62 | CA2 (0.50) | TSHRGAAALDH1A1KMT2AKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015160125-A1 | NOVEL PREPARATION METHOD OF QUINOLINE N-OXIDE DERIVATIVE WITH AMIDE GROUP | INSTITUTE FOR BASIC SCIENCE (KR) | 2015-10-22 | — | — | WO | disclosed |