Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.59 |
| ▸ | POLB | P06746 | 1/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.59 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | CA7 | P43166 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.50 |
| ▸ | SGMS1 | Q86VZ5 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL9718385 | 0.89 | ALDH1A1 (0.64) | ALDH1A1POLBMAPTSMN1; SMN2MEN1 | |
| SCHEMBL9718429 | 0.88 | TBXA2R (0.59) | ALDH1A1SMN1; SMN2SGMS1MEN1KMT2A | |
| SCHEMBL9718418 | 0.87 | TAAR1 (0.63) | ALDH1A1CYP1A2POLBCYP2D6CYP2C19 | |
| SCHEMBL10699471 | 0.87 | CYP1A2 (0.62) | ALDH1A1CYP1A2POLBCYP2D6CYP2C19 | |
| SCHEMBL10462381 | 0.81 | CYP1A2 (0.72) | ALDH1A1CYP1A2POLBCYP2D6CYP2C19 | |
| SCHEMBL9718367 | 0.81 | TBXAS1 (0.58) | TBXA2RTBXAS1 | |
| SCHEMBL10463166 | 0.81 | ALDH1A1 (0.61) | ALDH1A1POLBMAPTSMN1; SMN2GAA | |
| SCHEMBL10463248 | 0.80 | ALDH1A1 (0.64) | ALDH1A1POLBMAPTSMN1; SMN2SGMS1 | |
| SCHEMBL10461125 | 0.80 | ALDH1A1 (0.50) | ALDH1A1CYP1A2POLBCYP2D6CYP2C19 | |
| SCHEMBL640759 | 0.79 | LMNA (0.60) | ALDH1A1POLBMAPTSMN1; SMN2GAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0260527-B1 | SYNERGETIC COMBINATION COMPRISING A PHOSPHODIESTERASE INHIBITOR AND A THROMBOXAN-A2-ANTAGONIST, AND THEIR USE OR MANUFACTURE | Dr. Karl Thomae GmbH (DE) | 1992-04-01 | — | — | EP | disclosed |