Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | KHK | P50053 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.41 |
| ▸ | SLC1A5 | Q15758 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.37 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL9005125 | 0.81 | BACE1 (0.42) | ALDH1A1BACE1NPSR1KDM4EGAA | |
| SCHEMBL27699779 | 0.79 | KHK (0.49) | ALDH1A1KHKBACE1NPSR1CYP1A2 | |
| SCHEMBL27640795 | 0.79 | PKM (0.57) | ALDH1A1NPSR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL789748 | 0.79 | KDM4E (0.62) | ALDH1A1BACE1NPSR1SMN1; SMN2KDM4E | |
| SCHEMBL10809702 | 0.77 | NPSR1 (0.48) | ALDH1A1KHKNPSR1CYP1A2CYP2C9 | |
| SCHEMBL1514476 | 0.77 | ALDH1A1 (0.62) | ALDH1A1KHKNPSR1CYP1A2CYP2C9 | |
| SCHEMBL24971016 | 0.76 | BACE1 (0.47) | BACE1CYP1A2CYP2C9CYP2C19SMN1; SMN2 | |
| SCHEMBL30973192 | 0.76 | BACE1 (0.47) | BACE1CYP1A2CYP2C9CYP2C19SMN1; SMN2 | |
| SCHEMBL1289560 | 0.76 | L3MBTL1 (0.65) | ALDH1A1NPSR1SMN1; SMN2KDM4EGAA | |
| SCHEMBL7264790 | 0.76 | L3MBTL1 (0.47) | ALDH1A1BACE1NPSR1SMN1; SMN2KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-4710507-A | Quinolone inotropic agents | PFIZER INC. (US) | 1987-12-01 | — | — | US | disclosed |
| EP-0148623-A2 | Quinolone inotropic agents | Pfizer Limited (GB) | 1985-07-17 | — | — | EP | disclosed |