Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 4/20 | 0.52 |
| ▸ | CA12 | O43570 | 3/20 | 0.52 |
| ▸ | CA1 | P00915 | 3/20 | 0.52 |
| ▸ | CA7 | P43166 | 3/20 | 0.52 |
| ▸ | CA9 | Q16790 | 3/20 | 0.52 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.52 |
| ▸ | ACHE | P22303 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | CA4 | P22748 | 2/20 | 0.43 |
| ▸ | PDE4A | P27815 | 1/20 | 0.43 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.43 |
| ▸ | CA6 | P23280 | 1/20 | 0.43 |
| ▸ | TPMT | P51580 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Potassium Ion SCHEMBL15921079 | 0.79 | CA2 (0.46) | CA2CA12CA1CA7CA9 | |
| SCHEMBL4532734 | 0.74 | CYP3A4 (0.53) | CA2CA12CA1CA7CA9 | |
| SCHEMBL13518528 | 0.74 | CYP3A4 (0.53) | CA2CA12CA1CA7CA9 | |
| SCHEMBL8840880 | 0.70 | PDE4A (0.67) | CA2CA12CA1CA7CA9 | |
| SCHEMBL29403877 | 0.69 | ACHE (1.00) | CA2CA12CA1CA7CA9 | |
| 1,2,4-Trimethoxybenzene SCHEMBL29350371 | 0.69 | CA12 (1.00) | CA2CA12CA1CA7CA9 | |
| SCHEMBL1402508 | 0.69 | CA2 (0.56) | CA2CA12CA1CA7CA9 | |
| 1,2,4-Trimethoxybenzene SCHEMBL481491 | 0.69 | CA12 (1.00) | CA2CA12CA1CA7CA9 | |
| SCHEMBL12518 | 0.69 | ACHE (1.00) | CA2CA12CA1CA7CA9 | |
| 1,2,4-Trimethoxybenzene SCHEMBL27777905 | 0.69 | CA12 (1.00) | CA2CA12CA1CA7CA9 |
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 |
|---|---|---|---|---|---|---|---|
| US-6387975-B1 | ORGANOMETALLIC COMPOUND COMPLEX | AUTEX, INC. (JP) | 2002-05-14 | — | — | US | claimed |
| US-6387975-B1 | ORGANOMETALLIC COMPOUND COMPLEX | AUTEX, INC. (JP) | 2002-05-14 | — | — | US | disclosed |