Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 2/20 | 0.72 |
| ▸ | TARBP2 | Q15633 | 4/20 | 0.57 |
| ▸ | PDCD4 | Q53EL6 | 1/20 | 0.57 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.57 |
| ▸ | VDR | P11473 | 6/20 | 0.52 |
| ▸ | PPARD | Q03181 | 3/20 | 0.52 |
| ▸ | ESR1 | P03372 | 1/20 | 0.52 |
| ▸ | THRA | P10827 | 1/20 | 0.52 |
| ▸ | THRB | P10828 | 1/20 | 0.52 |
| ▸ | RXRA | P19793 | 1/20 | 0.52 |
| ▸ | PPARG | P37231 | 1/20 | 0.52 |
| ▸ | PPARA | Q07869 | 1/20 | 0.52 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL28297240 | 0.88 | TARBP2 (0.73) | IKBKBTARBP2PDCD4VDRPPARD | |
| SCHEMBL29158652 | 0.85 | TARBP2 (0.57) | IKBKBTARBP2PDCD4VDRPPARD | |
| SCHEMBL18039360 | 0.85 | TARBP2 (0.56) | IKBKBTARBP2PDCD4ADORA2AALDH1A1 | |
| SCHEMBL25165105 | 0.84 | IKBKB (0.57) | IKBKBTARBP2PDCD4ADORA2AVDR | |
| SCHEMBL1563637 | 0.84 | TARBP2 (0.71) | IKBKBTARBP2PDCD4ALDH1A1KDM4E | |
| SCHEMBL3606461 | 0.83 | VDR (0.59) | IKBKBTARBP2PDCD4VDRPPARD | |
| SCHEMBL31266863 | 0.81 | TARBP2 (0.50) | IKBKBTARBP2PDCD4ADORA2AALDH1A1 | |
| SCHEMBL23657560 | 0.79 | TARBP2 (0.56) | IKBKBTARBP2PDCD4ADORA2AALDH1A1 | |
| SCHEMBL1969979 | 0.79 | TARBP2 (0.50) | IKBKBTARBP2PDCD4RXRAALDH1A1 | |
| SCHEMBL28297236 | 0.78 | TARBP2 (0.69) | IKBKBTARBP2PDCD4VDRPPARD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023061294-A1 | NITROGEN-CONTAINING HETEROCYCLIC DERIVATIVE REGULATOR, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 再鼎医药(上海)有限公司 | 2023-04-20 | — | — | WO | disclosed |