Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDO2 | P48775 | 3/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.47 |
| ▸ | AXL | P30530 | 1/20 | 0.47 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.47 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.47 |
| ▸ | CYP11B1 | P15538 | 5/20 | 0.47 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | CYP17A1 | P05093 | 3/20 | 0.44 |
| ▸ | F2 | P00734 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL29450634 | 0.86 | TDO2 (0.54) | TDO2MEN1PSIP1AXLMKNK1 | |
| SCHEMBL145074 | 0.82 | AXL (0.59) | TDO2MEN1PSIP1AXLMKNK1 | |
| SCHEMBL15624620 | 0.82 | TDO2 (0.56) | TDO2CYP11B1CYP11B2ALDH1A1CYP3A4 | |
| Hydrochloric Acid SCHEMBL7090061 | 0.81 | AXL (0.58) | TDO2MEN1PSIP1AXLMKNK1 | |
| Hydrochloric Acid SCHEMBL6739740 | 0.81 | AXL (0.58) | TDO2MEN1PSIP1AXLMKNK1 | |
| SCHEMBL6171120 | 0.79 | CYP2A6 (0.51) | TDO2MEN1PSIP1AXLMKNK1 | |
| SCHEMBL3946385 | 0.79 | IDO1 (0.53) | TDO2MEN1PSIP1AXLMKNK1 | |
| SCHEMBL10094646 | 0.79 | TDO2 (0.54) | TDO2MKNK1MKNK2CYP11B1CYP11B2 | |
| SCHEMBL27824426 | 0.79 | TDO2 (0.56) | TDO2CYP11B1CYP11B2ALDH1A1CYP3A4 | |
| SCHEMBL29492484 | 0.77 | ALDH1A1 (0.54) | MKNK1MKNK2ALDH1A1HPGDCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019008025-A1 | NOVEL SULFONAMIDE CARBOXAMIDE COMPOUNDS | INFLAZOME LIMITED (IE) | 2019-01-10 | — | — | WO | disclosed |
| WO-2009097578-A1 | OXIM DERIVATIVES AS HSP90 INHIBITORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-08-06 | — | — | WO | disclosed |