Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.75 |
| ▸ | TSHR | P16473 | 5/20 | 0.75 |
| ▸ | NT5E | P21589 | 1/20 | 0.75 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.58 |
| ▸ | HTT | P42858 | 2/20 | 0.54 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.52 |
| ▸ | MMP2 | P08253 | 4/20 | 0.50 |
| ▸ | MMP9 | P14780 | 4/20 | 0.50 |
| ▸ | MAOA | P21397 | 2/20 | 0.50 |
| ▸ | MMP3 | P08254 | 1/20 | 0.50 |
| ▸ | MMP8 | P22894 | 1/20 | 0.50 |
| ▸ | MMP14 | P50281 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | XBP1 | P17861 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL23581821 | 1.00 | ALDH1A1 (0.75) | ALDH1A1TSHRNT5ETDP1CYP3A4 | |
| Sulfuric Acid SCHEMBL8640279 | 0.98 | ALDH1A1 (0.72) | ALDH1A1TSHRNT5ETDP1CYP3A4 | |
| SCHEMBL6090901 | 0.89 | ALDH1A1 (0.58) | ALDH1A1TSHRNT5ETDP1HTT | |
| SCHEMBL9249636 | 0.89 | ALDH1A1 (0.58) | ALDH1A1TSHRNT5ETDP1HTT | |
| SCHEMBL28521152 | 0.87 | ALDH1A1 (0.56) | ALDH1A1TSHRNT5ETDP1HTT | |
| Sulfuric Acid SCHEMBL8647113 | 0.87 | ALDH1A1 (0.70) | ALDH1A1TSHRNT5ETDP1CYP3A4 | |
| Sulfuric Acid SCHEMBL8644562 | 0.87 | ALDH1A1 (0.70) | ALDH1A1TSHRNT5ETDP1CYP3A4 | |
| SCHEMBL482994 | 0.87 | TSHR (1.00) | ALDH1A1TSHRNT5ETDP1CYP3A4 | |
| SCHEMBL30495973 | 0.87 | TSHR (1.00) | ALDH1A1TSHRNT5ETDP1CYP3A4 | |
| SCHEMBL24407 | 0.87 | TSHR (1.00) | ALDH1A1TSHRNT5ETDP1CYP3A4 |
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-5001146-A | — | — | None | — | — | JP | disclosed |
| JP-H051146-A | POLYAMIDE RESIN AND ITS COMPOSITION | MITSUI TOATSU CHEM INC | 1993-01-08 | — | — | JP | disclosed |