Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | CRHBP | P24387 | 1/20 | 0.38 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21410445 | 0.90 | ALDH1A1 (0.53) | L3MBTL1ALDH1A1SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL23245063 | 0.89 | ALDH1A1 (0.50) | L3MBTL1ALDH1A1SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL21410438 | 0.88 | MAPT (0.51) | L3MBTL1ALDH1A1SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL23245077 | 0.88 | L3MBTL1 (0.44) | L3MBTL1ALDH1A1SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL23245047 | 0.88 | MAPT (0.48) | L3MBTL1ALDH1A1SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL28480820 | 0.88 | L3MBTL1 (0.42) | L3MBTL1ALDH1A1SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL23245121 | 0.87 | HTT (0.53) | L3MBTL1ALDH1A1SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL23245072 | 0.87 | L3MBTL1 (0.45) | L3MBTL1ALDH1A1SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL21410815 | 0.87 | ALDH1A1 (0.52) | L3MBTL1ALDH1A1SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL23245059 | 0.87 | L3MBTL1 (0.43) | L3MBTL1ALDH1A1SMN1; SMN2KMT2AMEN1 |
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-111918864-A | Prodrug compounds activated by AKR1C3 and their use to treat hyperproliferative disorders | 阿基利斯医疗有限公司 | 2020-11-10 | — | — | CN | claimed |