Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.67 |
| ▸ | CA1 | P00915 | 6/20 | 0.53 |
| ▸ | CA2 | P00918 | 6/20 | 0.53 |
| ▸ | GBA1 | P04062 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.49 |
| ▸ | CA9 | Q16790 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.47 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.47 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.47 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.47 |
| ▸ | PDK4 | Q16654 | 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 | |
|---|---|---|---|---|
| SCHEMBL6324022 | 0.87 | CA1 (0.51) | ALDH1A1CA1CA2GBA1TSHR | |
| SCHEMBL10907021 | 0.84 | ALDH1A1 (0.73) | ALDH1A1CA1CA2GBA1TSHR | |
| SCHEMBL7862567 | 0.83 | GBA1 (0.74) | ALDH1A1CA1CA2GBA1GAA | |
| SCHEMBL5649673 | 0.82 | KMT2A (0.57) | ALDH1A1CA1CA2HPGDLMNA | |
| SCHEMBL6755663 | 0.81 | CA1 (0.77) | ALDH1A1CA1CA2GBA1GAA | |
| SCHEMBL3133953 | 0.81 | CA1 (0.75) | ALDH1A1CA1CA2GBA1GAA | |
| SCHEMBL2934786 | 0.81 | ALDH1A1 (0.67) | ALDH1A1CA1CA2GBA1GAA | |
| SCHEMBL6790764 | 0.81 | ALDH1A1 (0.67) | ALDH1A1CA1CA2GBA1GAA | |
| SCHEMBL13668160 | 0.81 | CA1 (0.75) | ALDH1A1CA1CA2GBA1GAA | |
| SCHEMBL9229800 | 0.81 | ALDH1A1 (0.67) | ALDH1A1CA1CA2GBA1GAA |
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 |
|---|---|---|---|---|---|---|---|
| CN-106458991-A | Benzenesulfonamide derivatives and their use as RORC modulators | 豪夫迈·罗氏有限公司 | 2017-02-22 | — | — | CN | disclosed |
| CN-104903291-A | Benzyl sulfonamide derivatives as RORc modulators | HOFFMANN LA ROCHE | 2015-09-09 | — | — | CN | disclosed |