Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.62 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.62 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.62 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | ESR1 | P03372 | 1/20 | 0.49 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 6/20 | 0.46 |
| ▸ | NPC1 | O15118 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL3804139 | 0.85 | TSHR (0.59) | KMT2ATDP1SLC6A2SLC6A3LMNA | |
| SCHEMBL3804138 | 0.85 | TSHR (0.55) | KMT2ATDP1SLC6A2SLC6A3LMNA | |
| SCHEMBL3072372 | 0.83 | ALDH1A1 (0.61) | KMT2ATDP1SLC6A2SLC6A3LMNA | |
| SCHEMBL21189480 | 0.83 | TSHR (0.51) | KMT2ATDP1SLC6A2SLC6A3LMNA | |
| SCHEMBL19509036 | 0.83 | ALDH1A1 (0.61) | KMT2ATDP1SLC6A2SLC6A3LMNA | |
| SCHEMBL5379773 | 0.81 | TSHR (0.61) | TSHRALDH1A1 | |
| SCHEMBL13347322 | 0.80 | TSHR (0.49) | KMT2ATDP1SLC6A2SLC6A3LMNA | |
| SCHEMBL21407732 | 0.79 | TSHR (0.51) | KMT2ATDP1SLC6A2SLC6A3LMNA | |
| SCHEMBL22905971 | 0.79 | SMN1; SMN2 (0.57) | KMT2ALMNATSHRALDH1A1MAPT | |
| SCHEMBL206609 | 0.79 | TSHR (0.68) | TSHRALDH1A1RAB9ANPC1 |
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-114364665-B | Prodrugs for modulating interleukins | 百时美施贵宝公司 | 2024-12-31 | — | — | CN | disclosed |