Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 6/20 | 0.40 |
| ▸ | CA2 | P00918 | 6/20 | 0.40 |
| ▸ | CA12 | O43570 | 5/20 | 0.40 |
| ▸ | CA9 | Q16790 | 5/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | VCAM1 | P19320 | 4/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | GRIN2D | O15399 | 4/20 | 0.35 |
| ▸ | GRIN3B | O60391 | 4/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.35 |
| ▸ | GRIN2A | Q12879 | 4/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 4/20 | 0.35 |
| ▸ | GRIN2C | Q14957 | 4/20 | 0.35 |
| ▸ | GRIN3A | Q8TCU5 | 4/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27571736 | 0.82 | CA2 (0.41) | CA1CA2CA12CA9ALDH1A1 | |
| SCHEMBL27552106 | 0.82 | MEN1 (0.40) | CA1CA2CA12CA9ALDH1A1 | |
| SCHEMBL27571711 | 0.79 | ALDH1A1 (0.41) | CA1CA2CA12CA9ALDH1A1 | |
| SCHEMBL27554671 | 0.75 | CA1 (0.38) | CA1CA2CA12CA9ALDH1A1 | |
| SCHEMBL6564129 | 0.73 | HSP90AA1 (0.43) | CA1CA2CA12CA9ALDH1A1 | |
| SCHEMBL6564153 | 0.73 | ALDH1A1 (0.46) | ALDH1A1CYP1A2CYP2C19POLBVCAM1 | |
| SCHEMBL27574462 | 0.70 | ALDH1A1 (0.39) | CA1CA2CA12CA9ALDH1A1 | |
| SCHEMBL6564226 | 0.69 | ALDH1A1 (0.33) | CA1CA2CA12CA9ALDH1A1 | |
| SCHEMBL4607518 | 0.68 | VCAM1 (0.54) | CA1CA2CA12CA9ALDH1A1 | |
| SCHEMBL9452233 | 0.67 | GPR35 (0.61) | ALDH1A1CYP1A2POLBHTT |
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 |
|---|---|---|---|---|---|---|---|
| CN-1334726-A | Hydroxy diphenyl urea sulfonamides as IL-8 receptor antagonists | SMITHKLINE BEECHAM CORP (US) | 2002-02-06 | — | — | CN | disclosed |