Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CLK1 | P49759 | 2/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 3/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | NAMPT | P43490 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL28423964 | 0.78 | CA2 (0.46) | CA2ALDH1A1KDM4EGAAHTT | |
| SCHEMBL24617281 | 0.77 | CA2 (0.49) | CA2CA1IMPDH2IMPDH1 | |
| SCHEMBL4599393 | 0.75 | CA2 (0.43) | CA2ALDH1A1KDM4EGAATSHR | |
| SCHEMBL29405311 | 0.75 | CA2 (0.43) | CA2ALDH1A1KDM4EGAATSHR | |
| SCHEMBL23178985 | 0.74 | CA2 (0.39) | CA2CA1ALDH1A1KDM4EGAA | |
| SCHEMBL7951292 | 0.73 | CA2 (0.41) | CA2ALDH1A1KDM4ETSHRL3MBTL1 | |
| Naphthalene SCHEMBL1637639 | 0.73 | CA2 (0.41) | CA2ALDH1A1KDM4EGAATSHR | |
| SCHEMBL23178987 | 0.72 | CA2 (0.40) | CA2ALDH1A1TSHRTDP1GABRA1 | |
| SCHEMBL19196145 | 0.72 | CA2 (0.50) | CA2CA1ALDH1A1KDM4EHTT | |
| SCHEMBL8972461 | 0.72 | DYRK1A (0.44) | CLK1DYRK1ACA2CA1ALDH1A1 |
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-5763601-A | SOLUBILITY, PURITY | Shirai, Hirofusa (JP) | 1998-06-09 | — | — | US | disclosed |
| US-5633370-A | Naphthalocyanine compounds, naphthalocyanine polymers and method for making | Shirai, Hirofusa (JP) | 1997-05-27 | — | — | US | disclosed |