Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | MAPT | P10636 | 5/20 | 0.45 |
| ▸ | MEN1 | O00255 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | ATM | Q13315 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.44 |
| ▸ | CDK9 | P50750 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL11344840 | 0.77 | POLB (0.53) | POLBCYP1A2CYP2C19GAAKDM4E | |
| SCHEMBL9223095 | 0.75 | ALDH1A1 (0.56) | POLBCYP1A2CYP2C19GAAKDM4E | |
| SCHEMBL2782602 | 0.75 | POLB (0.52) | POLBCYP1A2CYP2C19GAAKDM4E | |
| SCHEMBL28762296 | 0.74 | POLB (0.65) | POLBCYP1A2CYP2C19GAAKDM4E | |
| SCHEMBL1224747 | 0.73 | TDP1 (0.44) | POLBCYP2C19GAAALDH1A1MAPT | |
| SCHEMBL22357366 | 0.73 | POLB (0.53) | POLBGAAALDH1A1MAPTMEN1 | |
| SCHEMBL11382873 | 0.72 | CYP1A2 (0.59) | POLBCYP1A2CYP2C19GAAKDM4E | |
| SCHEMBL9819108 | 0.71 | POLB (0.47) | POLBCYP1A2CYP2C19GAAKDM4E | |
| SCHEMBL9819309 | 0.71 | GAA (0.58) | POLBCYP1A2CYP2C19GAAKDM4E | |
| SCHEMBL8410641 | 0.70 | MEN1 (0.54) | POLBCYP1A2CYP2C19GAAKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-0423269-A1 | HETEROARYL-3-OXO-PROPANENITRILE DERIVATIVES USEFUL IN THE TREATMENT OF RHEUMATOID ARTHRITIS AND OTHER AUTOIMMUNE DISEASES. | ERBA CARLO SPA (IT) | 1991-04-24 | — | — | EP | claimed |