Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.67 |
| ▸ | HSD17B10 | Q99714 | 8/20 | 0.67 |
| ▸ | TDP1 | Q9NUW8 | 7/20 | 0.67 |
| ▸ | RECQL | P46063 | 6/20 | 0.67 |
| ▸ | ALOX15 | P16050 | 5/20 | 0.67 |
| ▸ | HIF1A | Q16665 | 5/20 | 0.67 |
| ▸ | USP2 | O75604 | 4/20 | 0.67 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.67 |
| ▸ | FYN | P06241 | 3/20 | 0.67 |
| ▸ | LCK | P06239 | 3/20 | 0.67 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.67 |
| ▸ | HTR2A | P28223 | 2/20 | 0.67 |
| ▸ | SLC7A5 | Q01650 | 2/20 | 0.67 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.67 |
| ▸ | EGFR | P00533 | 2/20 | 0.67 |
| ▸ | KDM6B | O15054 | 1/20 | 0.64 |
| ▸ | HPGD | P15428 | 7/20 | 0.56 |
| ▸ | MAPT | P10636 | 7/20 | 0.56 |
| ▸ | BLM | P54132 | 5/20 | 0.56 |
| ▸ | POLB | P06746 | 5/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL490593 | 0.89 | KDM6B (0.72) | KDM4EHSD17B10TDP1RECQLALOX15 | |
| SCHEMBL2586662 | 0.86 | ALOX15 (0.58) | KDM4EHSD17B10TDP1RECQLALOX15 | |
| SCHEMBL846666 | 0.82 | LDHA (0.65) | TDP1ALOX15PTGS1BLMALDH1A1 | |
| SCHEMBL19369740 | 0.81 | KDM6B (0.73) | KDM4EHSD17B10TDP1RECQLALOX15 | |
| SCHEMBL19369736 | 0.81 | KDM6B (0.73) | KDM4EHSD17B10TDP1RECQLALOX15 | |
| Levodopa SCHEMBL29529163 | 0.81 | SLC7A5 (0.93) | KDM4EHSD17B10TDP1RECQLALOX15 | |
| SCHEMBL11664157 | 0.80 | KDM4E (0.59) | KDM4EHSD17B10TDP1RECQLALOX15 | |
| SCHEMBL1755353 | 0.80 | KDM6B (0.66) | KDM4EHSD17B10TDP1RECQLALOX15 | |
| Levodopa SCHEMBL22655 | 0.80 | SLC7A5 (1.00) | KDM4EHSD17B10TDP1RECQLALOX15 | |
| SCHEMBL10307925 | 0.80 | ALOX15 (0.63) | KDM4EHSD17B10TDP1RECQLALOX15 |
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-105130837-A | Tanshinol-leucine derivative and preparation method and application thereof | UNIV XI AN SCI & TECHNOLOGY | 2015-12-09 | — | — | CN | disclosed |