Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | LPAR6 | P43657 | 2/20 | 0.33 |
| ▸ | LPAR1 | Q92633 | 2/20 | 0.33 |
| ▸ | LPAR4 | Q99677 | 2/20 | 0.33 |
| ▸ | LPAR5 | Q9H1C0 | 2/20 | 0.33 |
| ▸ | LPAR2 | Q9HBW0 | 2/20 | 0.33 |
| ▸ | LPAR3 | Q9UBY5 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 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 | |
|---|---|---|---|---|
| Pentane SCHEMBL17090756 | 0.88 | TDP1 (0.39) | TDP1LMNATSHR | |
| Butyl Alcohol SCHEMBL6707779 | 0.87 | ALDH1A1 (0.42) | ALDH1A1TDP1SMN1; SMN2LMNATSHR | |
| Butoxyethanol SCHEMBL28570705 | 0.86 | TSHR (0.55) | ALDH1A1TDP1SMN1; SMN2LMNATSHR | |
| Butyl Alcohol SCHEMBL6707778 | 0.85 | TDP1 (0.56) | ALDH1A1TDP1SMN1; SMN2LMNATSHR | |
| SCHEMBL19000745 | 0.82 | TDP1 (0.37) | TDP1 | |
| SCHEMBL4544628 | 0.82 | TDP1 (0.37) | TDP1 | |
| SCHEMBL432060 | 0.82 | TDP1 (0.37) | TDP1 | |
| SCHEMBL97539 | 0.82 | TDP1 (0.37) | TDP1 | |
| SCHEMBL4905693 | 0.82 | TDP1 (0.37) | TDP1 | |
| SCHEMBL77962 | 0.82 | TDP1 (0.37) | TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112898823-A | Novel environment-friendly odorless printing ink and preparation method thereof | 陈曦 | 2021-06-04 | — | — | CN | claimed |
| CN-112898823-A | Novel environment-friendly odorless printing ink and preparation method thereof | 陈曦 | 2021-06-04 | — | — | CN | disclosed |