Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11041326 | 0.82 | ALDH1A1 (0.50) | ALDH1A1CYP3A4HSD17B10TSHRTDP1 | |
| SCHEMBL2894292 | 0.77 | LMNA (0.47) | ALDH1A1TSHRSLC6A4SLC6A2SLC6A3 | |
| SCHEMBL11061618 | 0.72 | ALDH1A1 (0.57) | ALDH1A1CYP3A4HSD17B10TSHRSLC6A4 | |
| SCHEMBL11252416 | 0.70 | ALDH1A1 (0.55) | ALDH1A1CYP3A4HSD17B10TSHRSMN1; SMN2 | |
| SCHEMBL3845018 | 0.70 | SLC6A4 (0.36) | ALDH1A1TDP1SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL8361642 | 0.69 | THRA (0.42) | TDP1SLC6A4SLC6A2SLC6A3SMN1; SMN2 | |
| SCHEMBL8864706 | 0.66 | GAA (0.46) | ALDH1A1TSHRSMN1; SMN2MEN1KMT2A | |
| SCHEMBL645965 | 0.66 | ALDH1A1 (0.38) | ALDH1A1HSD17B10TSHRMAPTCYP1A2 | |
| SCHEMBL10583347 | 0.66 | TDP1 (0.68) | TDP1SLC6A2SLC6A3MEN1KMT2A | |
| SCHEMBL3104267 | 0.66 | ALDH1A1 (0.58) | ALDH1A1CYP3A4HSD17B10TSHRTDP1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-61268690-A | — | — | None | — | — | JP | disclosed |
| JP-S61268690-A | ORGANIC PHOSPHORIC ACID ESTER DERIVATIVE AND INSECTICIDAL AND MITICIDAL COMPOSITION CONTAINING SAID DERIVATIVE AS ACTIVE COMPONENT | NIPPON KAYAKU CO LTD | 1986-11-28 | — | — | JP | disclosed |