Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.66 |
| ▸ | LMNA | P02545 | 5/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.64 |
| ▸ | MAPT | P10636 | 3/20 | 0.59 |
| ▸ | THRB | P10828 | 1/20 | 0.59 |
| ▸ | POLB | P06746 | 2/20 | 0.53 |
| ▸ | DPP4 | P27487 | 1/20 | 0.50 |
| ▸ | SLC6A5 | Q9Y345 | 6/20 | 0.49 |
| ▸ | SLC6A9 | P48067 | 5/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL13419533 | 1.00 | ALDH1A1 (0.66) | ALDH1A1LMNAKMT2AMAPTTHRB | |
| SCHEMBL14464189 | 0.88 | ALDH1A1 (0.79) | ALDH1A1LMNAKMT2AMAPTTHRB | |
| SCHEMBL28483262 | 0.88 | ALDH1A1 (0.54) | ALDH1A1LMNAKMT2AMAPTTHRB | |
| SCHEMBL993621 | 0.84 | ALDH1A1 (0.68) | ALDH1A1LMNAKMT2AMAPTKDM4E | |
| SCHEMBL32688941 | 0.84 | KMT2A (0.53) | ALDH1A1LMNAKMT2AMAPTTHRB | |
| SCHEMBL1813107 | 0.84 | KMT2A (0.53) | ALDH1A1LMNAKMT2AMAPTTHRB | |
| SCHEMBL854050 | 0.84 | ALDH1A1 (0.71) | ALDH1A1LMNAKMT2AMAPTTHRB | |
| SCHEMBL30198175 | 0.84 | ALDH1A1 (0.71) | ALDH1A1LMNAKMT2AMAPTTHRB | |
| SCHEMBL24267451 | 0.83 | ALDH1A1 (0.53) | ALDH1A1LMNAKMT2AMAPTTHRB | |
| SCHEMBL1127006 | 0.83 | ALDH1A1 (0.62) | ALDH1A1LMNAKMT2AMAPTTHRB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116003408-A | Heterocyclic compound, and preparation method and application thereof | 绵阳市中心医院 | 2023-04-25 | — | — | CN | disclosed |
| CN-115867549-A | 1H-pyrrolo [3,2-c ] pyridine and 1H-pyrrolo [2,3-c ] pyridine derivatives as TLR9 inhibitors for the treatment of fibrosis | 百时美施贵宝公司 | 2023-03-28 | — | — | CN | disclosed |