Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CCNC | P24863 | 1/20 | 0.37 |
| ▸ | CDK8 | P49336 | 1/20 | 0.37 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.36 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.36 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.35 |
| ▸ | ABL1 | P00519 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | HCK | P08631 | 1/20 | 0.35 |
| ▸ | SRC | P12931 | 1/20 | 0.35 |
| ▸ | KDR | P35968 | 1/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.35 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.35 |
| ▸ | MTOR | P42345 | 1/20 | 0.35 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.35 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.35 |
| ▸ | PRKDC | P78527 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12215859 | 0.80 | PIK3CD (0.41) | LMNAALDH1A1TSHRCCNCCDK8 | |
| SCHEMBL3109171 | 0.80 | HSD17B1 (0.41) | HPGDLMNAALDH1A1HSD17B1HSD17B2 | |
| SCHEMBL2169920 | 0.74 | MAPT (0.43) | LMNAALDH1A1CCNCCDK8PIK3CD | |
| SCHEMBL2173283 | 0.73 | KDM4E (0.50) | LMNAALDH1A1PIK3CDABL1EGFR | |
| SCHEMBL1023559 | 0.73 | ESR1 (0.41) | HSD17B1HSD17B2PIK3CDABL1EGFR | |
| SCHEMBL13221494 | 0.73 | HPGD (0.53) | HPGDALDH1A1TSHRHSD17B1HSD17B2 | |
| SCHEMBL28014367 | 0.70 | HPGD (0.39) | HPGDLMNAALDH1A1TSHRHSD17B1 | |
| SCHEMBL13706018 | 0.70 | PIK3CD (0.37) | LMNAALDH1A1CCNCCDK8PIK3CD | |
| SCHEMBL290185 | 0.70 | DPP4 (0.57) | HPGDLMNAALDH1A1NPC1MEN1 | |
| SCHEMBL18696938 | 0.69 | HPGD (0.62) | HPGDALDH1A1TSHRHSD17B1HSD17B2 |
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-103694195-B | Aromatic heterocyclic small molecular organic compounds and derivative, preparation method and medicinal use | EAST CHINA NORMAL UNIVERSITY (CN) | 2016-04-06 | — | — | CN | disclosed |