Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.38 |
| ▸ | RPA1 | P27694 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MET | P08581 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8318840 | 0.85 | CYP3A4 (0.35) | CYP1A2CYP3A4CYP2C19KDM4EMEN1 | |
| SCHEMBL8320659 | 0.79 | CYP1A2 (0.40) | CYP1A2CYP3A4CYP2C19MCL1RPA1 | |
| SCHEMBL8322152 | 0.76 | LMNA (0.44) | CYP1A2CYP3A4CYP2C19MCL1RPA1 | |
| SCHEMBL3599703 | 0.74 | CYP1A2 (0.49) | CYP1A2CYP3A4CYP2C19MCL1RPA1 | |
| SCHEMBL8321684 | 0.66 | MEN1 (0.43) | CYP1A2CYP3A4CYP2C19MCL1RPA1 | |
| SCHEMBL8319604 | 0.66 | LMNA (0.40) | MCL1RPA1KDM4EMEN1MAPT | |
| SCHEMBL16240062 | 0.65 | RHEB (0.45) | — | |
| SCHEMBL8318842 | 0.65 | CYP3A4 (0.35) | CYP1A2CYP3A4CYP2C19KDM4EMEN1 | |
| SCHEMBL8323736 | 0.64 | NPSR1 (0.41) | CYP1A2CYP3A4CYP2C19KDM4EMEN1 | |
| SCHEMBL8322193 | 0.62 | CYP1A2 (0.37) | CYP1A2CYP3A4CYP2C19KDM4EMEN1 |
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-5866594-A | Indole-2-carboxylate derivatives and fungicidal compositions for agricultural or horticultural use containing the derivatives as active component | OTSUKA KAGAKU KABUSHIKI KAISHA (JP) | 1999-02-02 | — | — | US | disclosed |