Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.53 |
| ▸ | HTT | P42858 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL13753815 | 0.83 | ALDH1A1 (0.76) | ALDH1A1KDM4ECYP1A2CYP2C9NPSR1 | |
| SCHEMBL11720308 | 0.79 | KDM4E (0.64) | ALDH1A1KDM4ECYP1A2CYP2C9NPSR1 | |
| SCHEMBL13753832 | 0.78 | ALDH1A1 (0.67) | ALDH1A1KDM4ECYP1A2CYP2C9NPSR1 | |
| SCHEMBL1433337 | 0.78 | ALDH1A1 (0.63) | ALDH1A1KDM4ECYP1A2CYP2C9NPSR1 | |
| SCHEMBL31390541 | 0.78 | ALDH1A1 (0.63) | ALDH1A1KDM4ECYP1A2CYP2C9NPSR1 | |
| SCHEMBL29793663 | 0.77 | KCNB1 (0.62) | ALDH1A1KDM4ECYP1A2CYP2C9POLB | |
| SCHEMBL10470110 | 0.75 | ALDH1A1 (0.52) | ALDH1A1KDM4ECYP1A2CYP2C9NPSR1 | |
| SCHEMBL10470176 | 0.75 | ALDH1A1 (0.52) | ALDH1A1KDM4ECYP1A2CYP2C9NPSR1 | |
| SCHEMBL5485870 | 0.74 | KDM4E (1.00) | ALDH1A1KDM4ECYP1A2CYP2C9NPSR1 | |
| SCHEMBL11784892 | 0.74 | KDM4E (0.79) | ALDH1A1KDM4ECYP1A2CYP2C9NPSR1 |
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-4013670-A | ANTIARRHYTHMICS | RIKER LABORATORIES, INC. (US) | 1977-03-22 | — | — | US | claimed |