Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.47 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | POLB | P06746 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | DDX3X | O00571 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CTSV | O60911 | 1/20 | 0.43 |
| ▸ | CTSL | P07711 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 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 | |
|---|---|---|---|---|
| SCHEMBL7169174 | 0.87 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2AKR1C3AKR1C2L3MBTL1 | |
| SCHEMBL398142 | 0.84 | ALDH1A1 (0.51) | ALDH1A1SMN1; SMN2AKR1C3AKR1C2L3MBTL1 | |
| SCHEMBL27681302 | 0.81 | AKR1C3 (0.47) | ALDH1A1SMN1; SMN2AKR1C3AKR1C2KMT2A | |
| SCHEMBL27681795 | 0.80 | ALDH1A1 (0.49) | ALDH1A1SMN1; SMN2AKR1C3AKR1C2L3MBTL1 | |
| SCHEMBL7166087 | 0.79 | CXCL8 (0.51) | ALDH1A1SMN1; SMN2MAPTCYP1A2CTSV | |
| SCHEMBL398027 | 0.76 | CYP1A2 (0.55) | ALDH1A1SMN1; SMN2AKR1C3AKR1C2L3MBTL1 | |
| SCHEMBL10091846 | 0.76 | CYP1A2 (0.66) | ALDH1A1SMN1; SMN2AKR1C3AKR1C2L3MBTL1 | |
| SCHEMBL4246352 | 0.72 | CTSV (0.70) | ALDH1A1SMN1; SMN2AKR1C3AKR1C2KMT2A | |
| SCHEMBL7165547 | 0.72 | L3MBTL1 (0.57) | ALDH1A1L3MBTL1KMT2APOLBMAPT | |
| SCHEMBL394734 | 0.70 | KMT2A (0.67) | ALDH1A1SMN1; SMN2L3MBTL1KMT2APOLB |
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 |
|---|---|---|---|---|---|---|---|
| CN-101056632-A | Compounds and compositions as protein kinase inhibitors | IRM LLC (BM) | 2007-10-17 | — | — | CN | disclosed |