Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ULK1 | O75385 | 1/20 | 0.43 |
| ▸ | CCNC | P24863 | 1/20 | 0.41 |
| ▸ | CDK8 | P49336 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | F9 | P00740 | 1/20 | 0.36 |
| ▸ | PLAU | P00749 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.35 |
| ▸ | KDR | P35968 | 1/20 | 0.35 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.35 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.35 |
| ▸ | F7 | P08709 | 2/20 | 0.35 |
| ▸ | F2 | P00734 | 1/20 | 0.35 |
| ▸ | F10 | P00742 | 1/20 | 0.35 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.35 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.35 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 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 | |
|---|---|---|---|---|
| SCHEMBL28589589 | 1.00 | ULK1 (0.43) | ULK1CCNCCDK8HSD17B10F9 | |
| SCHEMBL28581394 | 0.90 | ULK1 (0.43) | ULK1CCNCCDK8HSD17B10F9 | |
| SCHEMBL30169462 | 0.90 | ULK1 (0.43) | ULK1CCNCCDK8HSD17B10F9 | |
| SCHEMBL28585883 | 0.90 | TBXAS1 (0.38) | ULK1CCNCCDK8F9HPGD | |
| SCHEMBL30169441 | 0.89 | ULK1 (0.53) | ULK1CCNCCDK8F9PLAU | |
| SCHEMBL28603488 | 0.89 | ULK1 (0.53) | ULK1CCNCCDK8F9PLAU | |
| SCHEMBL30169386 | 0.84 | EDNRA (0.49) | CCNCCDK8HSD17B10F9HPGD | |
| SCHEMBL28586632 | 0.84 | EDNRA (0.49) | CCNCCDK8HSD17B10F9HPGD | |
| SCHEMBL28599943 | 0.84 | ULK1 (0.43) | ULK1CCNCCDK8F9PLAU | |
| SCHEMBL30169450 | 0.84 | ULK1 (0.43) | ULK1CCNCCDK8F9PLAU |
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-112358435-B | Substituted aromatic heterocyclic compound, preparation method, ULK1 inhibition and antitumor application | 中国医学科学院医药生物技术研究所 | 2023-01-10 | — | — | CN | disclosed |