Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.59 |
| ▸ | CA1 | P00915 | 2/20 | 0.59 |
| ▸ | CA2 | P00918 | 2/20 | 0.59 |
| ▸ | CA4 | P22748 | 2/20 | 0.59 |
| ▸ | CA6 | P23280 | 2/20 | 0.59 |
| ▸ | CA7 | P43166 | 2/20 | 0.59 |
| ▸ | CA9 | Q16790 | 2/20 | 0.59 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.59 |
| ▸ | TPMT | P51580 | 1/20 | 0.59 |
| ▸ | HTT | P42858 | 2/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | TTR | P02766 | 2/20 | 0.49 |
| ▸ | PKM | P14618 | 2/20 | 0.47 |
| ▸ | CA3 | P07451 | 1/20 | 0.47 |
| ▸ | CA5A | P35218 | 1/20 | 0.47 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.47 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Formic Acid SCHEMBL27282861 | 0.94 | CA12 (0.53) | CA12CA1CA2CA4CA6 | |
| SCHEMBL30143532 | 0.87 | CA12 (0.62) | CA12CA1CA2CA4CA6 | |
| SCHEMBL2784039 | 0.87 | CA12 (0.62) | CA12CA1CA2CA4CA6 | |
| SCHEMBL5832949 | 0.86 | MAPT (0.54) | CA12CA1CA2CA7CA9 | |
| SCHEMBL9952051 | 0.85 | CA12 (0.61) | CA12CA1CA2CA4CA6 | |
| SCHEMBL15573768 | 0.84 | CA12 (0.59) | CA12CA1CA2CA4CA6 | |
| SCHEMBL9182373 | 0.84 | HTT (0.60) | CA12CA1CA2CA4CA6 | |
| SCHEMBL6859656 | 0.83 | CA12 (0.67) | CA12CA1CA2CA4CA6 | |
| SCHEMBL2592749 | 0.83 | CA12 (0.67) | CA12CA1CA2CA4CA6 | |
| SCHEMBL20178600 | 0.83 | AGTR1 (0.58) | CA12CA1CA2CA4CA6 |
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-2023104165-A1 | PYRIDINE[4,3-D]PYRIMIDINE COMPOUND AS TLR7/8 AGONIST | 上海维申医药有限公司 | 2023-06-15 | — | — | WO | disclosed |
| CN-104910061-A | Preparation technology of zafirlukast intermediate | UNIV BOHAI | 2015-09-16 | — | — | CN | disclosed |