Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 2/20 | 0.49 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | RORC | P51449 | 2/20 | 0.36 |
| ▸ | DNMT1 | P26358 | 3/20 | 0.36 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 2/20 | 0.35 |
| ▸ | FNTA | P49354 | 1/20 | 0.35 |
| ▸ | FNTB | P49356 | 1/20 | 0.35 |
| ▸ | PGGT1B | P53609 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28367813 | 0.89 | KIF11 (0.48) | KIF11KDM1AALDH1A1PDK2AR | |
| SCHEMBL28574243 | 0.88 | KIF11 (0.50) | KIF11KDM1APGRFNTAFNTB | |
| SCHEMBL28570002 | 0.88 | ADRA2C (0.40) | KIF11DNMT1SLC22A12CNR1CNR2 | |
| SCHEMBL24002727 | 0.87 | KIF11 (0.51) | KIF11KDM1ARORCPGRFNTA | |
| SCHEMBL18361182 | 0.87 | KIF11 (0.47) | KIF11KDM1APGRFNTAFNTB | |
| SCHEMBL26533147 | 0.86 | KIF11 (0.42) | KIF11KDM1APGRFNTAFNTB | |
| SCHEMBL28371565 | 0.86 | RORC (0.36) | KIF11RORCDNMT1PGRNPC1 | |
| SCHEMBL28367118 | 0.86 | KIF11 (0.41) | KIF11RORCDNMT1CNR1CNR2 | |
| SCHEMBL28371444 | 0.86 | KIF11 (0.37) | KIF11DNMT1FNTAFNTBPGGT1B | |
| SCHEMBL28371604 | 0.86 | KIF11 (0.40) | KIF11DNMT1PGRALDH1A1PDK2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112638874-A | Benzonitrile derivative, light-emitting material, and light-emitting element using the same | 国立大学法人九州大学 | 2021-04-09 | — | — | CN | disclosed |
| CN-110914378-A | Composition for use in organic light emitting diodes | 九州有机光材股份有限公司 | 2020-03-24 | — | — | CN | disclosed |