Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | MMP1 | P03956 | 3/20 | 0.45 |
| ▸ | MMP13 | P45452 | 3/20 | 0.45 |
| ▸ | PKM | P14618 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | MMP2 | P08253 | 1/20 | 0.42 |
| ▸ | MMP9 | P14780 | 1/20 | 0.42 |
| ▸ | MMP8 | P22894 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8713414 | 0.88 | MMP13 (0.43) | HTTLMNASMN1; SMN2MMP1MMP13 | |
| SCHEMBL9755721 | 0.86 | ALDH1A1 (0.50) | ALDH1A1HTTLMNAHPGDSMN1; SMN2 | |
| SCHEMBL9755727 | 0.83 | MEN1 (0.58) | ALDH1A1HTTLMNAHPGDTP53 | |
| SCHEMBL9755720 | 0.83 | ALDH1A1 (0.56) | ALDH1A1LMNAHPGDSMN1; SMN2GAA | |
| SCHEMBL12827982 | 0.79 | PKM (0.52) | ALDH1A1HTTSMN1; SMN2MMP1MMP13 | |
| SCHEMBL9755706 | 0.78 | ALDH1A1 (0.42) | ALDH1A1LMNAHPGDSMN1; SMN2CA1 | |
| SCHEMBL28942001 | 0.78 | EGFR (0.53) | ALDH1A1HTTLMNAHPGDTP53 | |
| SCHEMBL4113521 | 0.78 | HDAC3 (0.53) | ALDH1A1HTTCA1CA2 | |
| SCHEMBL5860986 | 0.77 | ALDH1A1 (0.43) | ALDH1A1HTTLMNAHPGDTP53 | |
| SCHEMBL5860990 | 0.77 | ALDH1A1 (0.43) | ALDH1A1HTTLMNAHPGDTP53 |
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-1991006533-A1 | NOVEL PROCESS FOR MANUFACTURING COMPOUNDS WITH VALUABLE PHARMACOLOGICAL PROPERTIES AND NEW INTERMEDIATE PRODUCTS FOR THE MANUFACTURE OF THESE COMPOUNDS | BOEHRINGER MANNHEIM GMBH (DE) | 1991-05-16 | — | — | WO | disclosed |