Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.41 |
| ▸ | HTT | P42858 | 4/20 | 0.41 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KDR | P35968 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9637625 | 0.91 | NPC1 (0.56) | NPC1SMN1; SMN2HTTRAB9AKMT2A | |
| SCHEMBL28898320 | 0.80 | KMT2A (0.47) | NPC1SMN1; SMN2HTTRAB9AKMT2A | |
| SCHEMBL10745616 | 0.79 | KMT2A (0.53) | NPC1SMN1; SMN2HTTRAB9AKMT2A | |
| SCHEMBL4928317 | 0.77 | CA12 (0.46) | NPC1HTTRAB9AKMT2AMEN1 | |
| SCHEMBL4925630 | 0.77 | NPC1 (0.50) | NPC1HTTRAB9AKMT2ALMNA | |
| SCHEMBL13818425 | 0.75 | POLB (0.62) | NPC1SHMT2SMN1; SMN2HTTRAB9A | |
| SCHEMBL1620480 | 0.75 | KMT2A (0.43) | NPC1HTTRAB9AKMT2ALMNA | |
| SCHEMBL23234468 | 0.74 | KMT2A (0.42) | NPC1SMN1; SMN2HTTRAB9AKMT2A | |
| Hydrochloric Acid SCHEMBL28516416 | 0.73 | KMT2A (0.42) | NPC1HTTRAB9AKMT2ALMNA | |
| Fluoride SCHEMBL23234546 | 0.73 | NPC1 (0.43) | NPC1HTTRAB9AKMT2ALMNA |
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-2023119308-A1 | NOVEL, SAFE, ECONOMICAL AND AN EFFICIENT PROCESS FOR PREPARATION OF 3-FLUORO-2-NITRO PYRIDINE OF FORMULA I | AASTRID LIFE SCIENCES PVT. LTD. (IN) | 2023-06-29 | — | — | WO | disclosed |