Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 8/20 | 0.58 |
| ▸ | CA1 | P00915 | 5/20 | 0.58 |
| ▸ | CA9 | Q16790 | 5/20 | 0.58 |
| ▸ | GAA | P10253 | 4/20 | 0.58 |
| ▸ | CA12 | O43570 | 4/20 | 0.58 |
| ▸ | MAPT | P10636 | 2/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | PNMT | P11086 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11413488 | 0.87 | PNMT (0.44) | CA2CA1CA9GAACA12 | |
| SCHEMBL7156223 | 0.84 | POLB (0.49) | CA2CA1CA9GAACA12 | |
| SCHEMBL28100405 | 0.79 | GAA (0.66) | CA2CA1CA9GAACA12 | |
| SCHEMBL634041 | 0.79 | GAA (0.66) | CA2CA1CA9GAACA12 | |
| SCHEMBL8189450 | 0.78 | ALDH1A1 (0.57) | CA2CA1CA9GAACA12 | |
| SCHEMBL5674108 | 0.77 | ALDH1A1 (0.67) | CA2CA1CA9GAACA12 | |
| SCHEMBL10910948 | 0.77 | CA2 (0.63) | CA2CA1CA9GAACA12 | |
| SCHEMBL11789980 | 0.77 | GAA (0.63) | CA2CA1CA9GAACA12 | |
| Hydrochloric Acid SCHEMBL9497123 | 0.77 | GAA (0.63) | CA2CA1CA9GAACA12 | |
| SCHEMBL10527657 | 0.76 | CA2 (0.59) | CA2CA1CA9GAACA12 |
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 |
|---|---|---|---|---|---|---|---|
| US-4245007-A | OPTICAL BRIGHTENERS | CIBA-GEIGY CORPORATION (US) | 1981-01-13 | — | — | US | disclosed |