Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASR | P41180 | 4/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9826654 | 0.85 | AKR1C3 (0.36) | CASRAKR1C3AKR1C2CYP1A2CYP2A6 | |
| SCHEMBL9826826 | 0.82 | CASR (0.41) | CASRL3MBTL1SMN1; SMN2GLACNR2 | |
| SCHEMBL9826316 | 0.81 | ALDH1A1 (0.36) | CASRALDH1A1 | |
| SCHEMBL9825534 | 0.80 | CNR1 (0.46) | L3MBTL1GAATDP1CNR2CNR1 | |
| SCHEMBL9826194 | 0.80 | CASR (0.38) | CASRL3MBTL1SMN1; SMN2GAATDP1 | |
| SCHEMBL9826610 | 0.78 | CASR (0.38) | CASRL3MBTL1SMN1; SMN2GLAALDH1A1 | |
| SCHEMBL9875961 | 0.75 | CASR (0.35) | CASRL3MBTL1CNR2ALDH1A1LMNA | |
| SCHEMBL9825966 | 0.75 | CASR (0.36) | CASRL3MBTL1SMN1; SMN2CNR2CYP1A2 | |
| SCHEMBL9824893 | 0.72 | NCF1 (0.43) | SMN1; SMN2TDP1CNR2ALDH1A1CNR1 | |
| SCHEMBL14495326 | 0.71 | CALM1 (0.50) | CASRL3MBTL1SMN1; SMN2GLATDP1 |
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-5037575-A | Photostability | MITSUBISHI CHEMICAL INDUSTRIES LTD. (JP) | 1991-08-06 | — | — | US | disclosed |
| EP-0187015-B1 | SQUARILIUM COMPOUND AND LIQUID CRYSTAL COMPOSITION CONTAINING THE SAME | MITSUBISHI KASEI CORPORATION (JP) | 1991-05-29 | — | — | EP | disclosed |