Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 19/20 | 0.55 |
| ▸ | CA2 | P00918 | 19/20 | 0.55 |
| ▸ | CA12 | O43570 | 17/20 | 0.55 |
| ▸ | CA9 | Q16790 | 17/20 | 0.55 |
| ▸ | CA4 | P22748 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Zinc Ion SCHEMBL15157993 | 0.82 | CA12 (0.65) | CA1CA2CA12CA9ALDH1A1 | |
| Potassium Ion SCHEMBL4848549 | 0.80 | — | — | |
| SCHEMBL9778631 | 0.80 | CA12 (0.50) | CA1CA2CA12CA9ALDH1A1 | |
| Zinc Ion SCHEMBL180551 | 0.78 | CA12 (0.82) | CA1CA2CA12CA9ALDH1A1 | |
| SCHEMBL9308111 | 0.76 | CA12 (0.56) | CA1CA2CA12CA9ALDH1A1 | |
| SCHEMBL9778605 | 0.76 | CA12 (0.56) | CA1CA2CA12CA9CA4 | |
| SCHEMBL9806594 | 0.76 | CA12 (0.56) | CA1CA2CA12CA9ALDH1A1 | |
| Potassium Ion SCHEMBL9306627 | 0.76 | CA12 (0.61) | CA1CA2CA12CA9ALDH1A1 | |
| Zinc Ion SCHEMBL15463383 | 0.76 | CA12 (0.95) | CA1CA2CA12CA9 | |
| SCHEMBL9307201 | 0.76 | CA12 (0.56) | CA1CA2CA12CA9ALDH1A1 |
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-5211959-A | Clathrates of urea | JAPAN ATOMIC ENERGY RESEARCH INSTITUTE (JP) | 1993-05-18 | — | — | US | disclosed |
| US-4434165-A | Fungicidal compositions | HOFFMANN-LA ROCHE INC. (US) | 1984-02-28 | — | — | US | disclosed |