Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | GAA | P10253 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA3 | P07451 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CA6 | P23280 | 1/20 | 0.42 |
| ▸ | CA5A | P35218 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.42 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11686242 | 0.88 | ALDH1A1 (0.51) | ALDH1A1GAAKDM4ECA12CA1 | |
| SCHEMBL11689501 | 0.87 | L3MBTL1 (0.48) | ALDH1A1GAACA12CA1CA2 | |
| SCHEMBL11690411 | 0.85 | ALDH1A1 (0.47) | ALDH1A1GAAKDM4ECA12CA1 | |
| SCHEMBL9645218 | 0.85 | CA1 (0.64) | ALDH1A1GAAKDM4ECA12CA1 | |
| SCHEMBL11687579 | 0.84 | CYP1A2 (0.48) | ALDH1A1GAACA12CA1CA2 | |
| SCHEMBL9646464 | 0.84 | ALDH1A1 (0.46) | ALDH1A1GAAKDM4ECA12CA1 | |
| SCHEMBL11398952 | 0.82 | TSHR (0.54) | ALDH1A1GAACA12CA9POLB | |
| SCHEMBL4612138 | 0.80 | GAA (0.46) | ALDH1A1GAACA12CA1CA2 | |
| SCHEMBL11689629 | 0.80 | GSTO1 (0.51) | ALDH1A1GAACA12CA1CA2 | |
| SCHEMBL11761880 | 0.80 | POLB (0.66) | ALDH1A1GAAKDM4ECA12CA1 |
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-4754024-A | Fibre-reactive azo dyes containing vinylsulfonyl or analogous groups | CIBA-GEIGY CORPORATION | 1988-06-28 | — | — | US | disclosed |
| US-4026931-A | AZO DYES, FIBER-REACTIVE; INDOLE OR 5-AMINO-PYRAZOLE COUPLING COMPONENT | BAYER AKTIENGESELLSCHAFT (DT) | 1977-05-31 | — | — | US | disclosed |