Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | PLK1 | P53350 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.40 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.40 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.40 |
| ▸ | RXRA | P19793 | 1/20 | 0.40 |
| ▸ | RXRB | P28702 | 1/20 | 0.40 |
| ▸ | LPL | P06858 | 1/20 | 0.39 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28536814 | 0.82 | ALDH1A1 (0.50) | ALDH1A1PLK1SMN1; SMN2TDP1TAAR1 | |
| SCHEMBL28031818 | 0.79 | HDAC3 (0.47) | TAAR1MAPT | |
| SCHEMBL9421083 | 0.76 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2TDP1MAPTHTT | |
| SCHEMBL9017245 | 0.75 | ALDH1A1 (0.55) | ALDH1A1TDP1MAPTHTTRAB9A | |
| Formic Acid SCHEMBL27430708 | 0.74 | ALDH1A1 (0.54) | ALDH1A1PLK1SMN1; SMN2TAAR1LPL | |
| SCHEMBL31294308 | 0.74 | ALDH1A1 (0.50) | ALDH1A1PLK1SMN1; SMN2TDP1TAAR1 | |
| SCHEMBL10705859 | 0.73 | ESR1 (0.50) | ALDH1A1MAPTHTTRAB9ALMNA | |
| SCHEMBL25357085 | 0.72 | THRA (0.51) | TDP1 | |
| SCHEMBL1483694 | 0.72 | ALDH1A1 (0.59) | ALDH1A1PLK1SMN1; SMN2TDP1TAS1R3 | |
| SCHEMBL9519750 | 0.71 | CES2 (0.48) | SMN1; SMN2MAPTRAB9A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104926629-B | Domino reaction is utilized to prepare the green method of 3,3-diaryl acrylic aldehyde | 江苏科本医药化学有限公司 | 2016-06-22 | — | — | CN | claimed |
| CN-104926629-A | Environment-friendly method for preparing 3,3-diaryl acrolein by utilizing domino reaction | JIANGSU COBEN PHARMACEUTICAL CO LTD | 2015-09-23 | — | — | CN | claimed |
| CN-104926629-B | Domino reaction is utilized to prepare the green method of 3,3-diaryl acrylic aldehyde | 江苏科本医药化学有限公司 | 2016-06-22 | — | — | CN | disclosed |
| CN-104926629-A | Environment-friendly method for preparing 3,3-diaryl acrolein by utilizing domino reaction | JIANGSU COBEN PHARMACEUTICAL CO LTD | 2015-09-23 | — | — | CN | disclosed |