Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.82 |
| ▸ | MAPT | P10636 | 2/20 | 0.82 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.82 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.82 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.82 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.82 |
| ▸ | TSHR | P16473 | 1/20 | 0.82 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.82 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.82 |
| ▸ | BLM | P54132 | 1/20 | 0.82 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.82 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.82 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.82 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.82 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.47 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1938827 | 0.90 | ALDH1A1 (1.00) | ALDH1A1MAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL29766970 | 0.90 | ALDH1A1 (1.00) | ALDH1A1MAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7299109 | 0.88 | ALDH1A1 (0.82) | ALDH1A1MAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7299183 | 0.87 | MAPT (0.84) | ALDH1A1MAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7293424 | 0.87 | ALDH1A1 (0.84) | ALDH1A1MAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7290516 | 0.86 | MAPT (0.82) | ALDH1A1MAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7299844 | 0.86 | ALDH1A1 (0.82) | ALDH1A1MAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7290124 | 0.85 | MAPT (0.80) | ALDH1A1MAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7298135 | 0.85 | MAPT (0.80) | ALDH1A1MAPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7291651 | 0.84 | ALDH1A1 (0.79) | ALDH1A1MAPTCYP1A2CYP3A4CYP2D6 |
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-0300688-A1 | Pyrrole derivatives, process for their preparation and pharmaceutical compositions containing them | FISONS plc (GB) | 1989-01-25 | — | — | EP | claimed |
| EP-0300688-A1 | Pyrrole derivatives, process for their preparation and pharmaceutical compositions containing them | FISONS plc (GB) | 1989-01-25 | — | — | EP | disclosed |