Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.69 |
| ▸ | RXRA | P19793 | 2/20 | 0.53 |
| ▸ | RXRB | P28702 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | BCL2 | P10415 | 1/20 | 0.45 |
| ▸ | PLK1 | P53350 | 1/20 | 0.44 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | RARB | P10826 | 6/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Azetidine SCHEMBL28353834 | 0.95 | ALDH1A1 (0.77) | ALDH1A1RXRARXRBSMN1; SMN2RAB9A | |
| Terephthalic Acid SCHEMBL28988329 | 0.85 | TSHR (0.57) | ALDH1A1SMN1; SMN2RAB9ANPC1OPRD1 | |
| Terephthalic Acid SCHEMBL9063579 | 0.85 | TSHR (0.57) | ALDH1A1SMN1; SMN2RAB9ANPC1OPRD1 | |
| Terephthalic Acid SCHEMBL19063513 | 0.83 | TSHR (0.55) | ALDH1A1SMN1; SMN2RAB9ANPC1OPRD1 | |
| SCHEMBL1330795 | 0.83 | ALDH1A1 (1.00) | ALDH1A1RXRARXRBSMN1; SMN2RAB9A | |
| SCHEMBL19901 | 0.83 | ALDH1A1 (1.00) | ALDH1A1RXRARXRBSMN1; SMN2RAB9A | |
| Terephthalic Acid SCHEMBL31729036 | 0.83 | TSHR (0.60) | ALDH1A1SMN1; SMN2RAB9ANPC1OPRD1 | |
| SCHEMBL1330335 | 0.83 | ALDH1A1 (1.00) | ALDH1A1RXRARXRBSMN1; SMN2RAB9A | |
| Piperidine SCHEMBL17747534 | 0.83 | ALDH1A1 (0.46) | ALDH1A1RXRARXRBKMT2ARARB | |
| SCHEMBL6909050 | 0.81 | ALDH1A1 (0.95) | ALDH1A1RXRARXRBSMN1; SMN2RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-118146234-A | 6,5,7,6-Tetracyclic derivatives, preparation method and application thereof | 浙江我武翼方药业有限公司 | 2024-06-07 | — | — | CN | disclosed |