Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | SLC15A1 | P46059 | 2/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7298763 | 0.81 | ALDH1A1 (0.50) | ALDH1A1MAPK1L3MBTL1EPHX1KMT2A | |
| SCHEMBL11785838 | 0.80 | ALDH1A1 (0.50) | ALDH1A1MAPK1L3MBTL1KMT2ASLC6A2 | |
| SCHEMBL1705106 | 0.80 | ALDH1A1 (0.56) | ALDH1A1MAPK1L3MBTL1EPHX1KMT2A | |
| SCHEMBL21634088 | 0.79 | ALDH1A1 (0.52) | ALDH1A1MAPK1L3MBTL1EPHX1KMT2A | |
| SCHEMBL28207458 | 0.79 | CHRM1 (0.63) | ALDH1A1MAPK1L3MBTL1EPHX1KMT2A | |
| SCHEMBL27494792 | 0.79 | ALDH1A1 (0.52) | ALDH1A1MAPK1L3MBTL1EPHX1KMT2A | |
| SCHEMBL14691416 | 0.79 | CHRM1 (0.63) | ALDH1A1MAPK1L3MBTL1EPHX1KMT2A | |
| SCHEMBL28321676 | 0.79 | SLC15A1 (0.49) | ALDH1A1MAPK1L3MBTL1KMT2ASLC6A2 | |
| SCHEMBL3905721 | 0.78 | LMNA (0.50) | ALDH1A1MAPK1L3MBTL1EPHX1KMT2A | |
| SCHEMBL28208115 | 0.78 | AAK1 (0.39) | ALDH1A1L3MBTL1EPHX1KMT2ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5830869-A | METALLOPROTEASE INHIBITOR | PHARMACIA & UPJOHN COMPANY | 1998-11-03 | — | — | US | disclosed |