Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | PTPRC | P08575 | 3/20 | 0.42 |
| ▸ | S100A4 | P26447 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.38 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30095404 | 0.83 | ALDH1A1 (0.51) | ALDH1A1PTPRCS100A4MAPTKDM4E | |
| SCHEMBL4702204 | 0.83 | ALDH1A1 (0.51) | ALDH1A1PTPRCS100A4MAPTKDM4E | |
| SCHEMBL2532509 | 0.67 | ALDH1A1 (0.51) | ALDH1A1PTPRCS100A4MAPTKDM4E | |
| SCHEMBL6673213 | 0.67 | ALDH1A1 (0.51) | ALDH1A1PTPRCS100A4MAPTKDM4E | |
| SCHEMBL12181050 | 0.66 | PTPRC (0.67) | ALDH1A1PTPRCS100A4MAPTKDM4E | |
| SCHEMBL13508699 | 0.66 | ALDH1A1 (0.74) | ALDH1A1PTPRCS100A4MAPTKDM4E | |
| SCHEMBL7741732 | 0.64 | PTPRC (0.63) | ALDH1A1PTPRCS100A4MAPTKDM4E | |
| SCHEMBL19207373 | 0.64 | TSHR (0.56) | ALDH1A1PTPRCS100A4MAPTKDM4E | |
| SCHEMBL19243529 | 0.64 | TSHR (0.56) | ALDH1A1PTPRCS100A4MAPTKDM4E | |
| SCHEMBL25407711 | 0.64 | ALDH1A1 (0.55) | ALDH1A1PTPRCS100A4MAPTKDM4E |
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-2013072825-A1 | PHTALAZINONE DERIVATIVES AS MPEGS -1 INHIBITORS | GLENMARK PHARMACEUTICALS S.A. (CH) | 2013-05-23 | — | — | WO | disclosed |