Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.40 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 5/20 | 0.39 |
| ▸ | HPGD | P15428 | 4/20 | 0.39 |
| ▸ | GLA | P06280 | 4/20 | 0.39 |
| ▸ | CASP1 | P29466 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 7/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | NQO2 | P16083 | 3/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10608665 | 0.88 | ALDH1A1 (0.48) | KDM4EALDH1A1MAPTGAAHPGD | |
| SCHEMBL2321373 | 0.74 | ALDH1A1 (0.46) | KDM4EALDH1A1MAPTGAAHPGD | |
| SCHEMBL10609653 | 0.73 | ALDH1A1 (0.46) | KDM4EALDH1A1MAPTGAAHPGD | |
| SCHEMBL10402359 | 0.72 | ALDH1A1 (0.55) | KDM4EALDH1A1MAPTADRB2ADRB1 | |
| SCHEMBL10402573 | 0.71 | ALDH1A1 (0.54) | KDM4EALDH1A1MAPTGAAHPGD | |
| SCHEMBL9464905 | 0.70 | MAOB (0.45) | KDM4EALDH1A1HPGDMAOBNPC1 | |
| SCHEMBL16335003 | 0.70 | KDM4E (0.45) | KDM4EALDH1A1MAPTGAAHPGD | |
| SCHEMBL1983678 | 0.70 | ALDH1A1 (0.53) | KDM4EALDH1A1MAPTGAAHPGD | |
| SCHEMBL30251078 | 0.70 | ALDH1A1 (0.53) | KDM4EALDH1A1MAPTGAAHPGD | |
| SCHEMBL10611967 | 0.70 | ALDH1A1 (0.45) | KDM4EALDH1A1MAPTGAAHPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-0271550-A1 | BENZOPYRAN AND BENZOTHIOPYRAN DERIVATIVES AND COMPOSITIONS CONTAINING THEM | ALKALOIDA VEGYéSZETI GYáR (HU) | 1988-06-22 | — | — | EP | disclosed |
| WO-1988000197-A1 | BENZOPYRAN AND BENZOTHIOPYRAN DERIVATIVES AND COMPOSITIONS CONTAINING THEM | ALKALOIDA VEGYE^´SZETI GYA^´R (HU) | 1988-01-14 | — | — | WO | disclosed |