Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 5/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | ELANE | P08246 | 1/20 | 0.47 |
| ▸ | PRTN3 | P24158 | 1/20 | 0.47 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL15598267 | 1.00 | KDM4E (0.56) | KDM4EALDH1A1HPGDSMN1; SMN2TSHR | |
| SCHEMBL13954253 | 0.90 | KDM4E (0.56) | KDM4EALDH1A1HPGDSMN1; SMN2TSHR | |
| SCHEMBL13954255 | 0.89 | KDM4E (0.54) | KDM4EALDH1A1HPGDSMN1; SMN2TSHR | |
| SCHEMBL7505664 | 0.89 | CTSS (0.57) | KDM4EALDH1A1HPGDSMN1; SMN2TSHR | |
| SCHEMBL28103795 | 0.87 | CTSK (0.51) | KDM4ETP53 | |
| SCHEMBL15598266 | 0.87 | CTSK (0.51) | KDM4ETP53 | |
| SCHEMBL13954047 | 0.84 | CTSS (0.60) | KDM4EALDH1A1HPGDSMN1; SMN2TSHR | |
| SCHEMBL28493853 | 0.84 | KDM4E (0.60) | KDM4EALDH1A1HPGDSMN1; SMN2TSHR | |
| SCHEMBL10163667 | 0.83 | RXFP1 (0.52) | KDM4EALDH1A1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL8665277 | 0.81 | CTSS (0.58) | KDM4ELMNA |
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-104768952-B | PI3K inhibitors | 山东亨利医药科技有限责任公司 | 2016-10-19 | — | — | CN | disclosed |