Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 2/20 | 0.38 |
| ▸ | CA9 | Q16790 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | PTGES | O14684 | 1/20 | 0.34 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10914265 | 0.82 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2TSHRNPSR1ESR1 | |
| SCHEMBL9541745 | 0.81 | ALDH1A1 (0.44) | ALDH1A1NPSR1ESR1CA12CA9 | |
| SCHEMBL28512057 | 0.77 | CA12 (0.47) | ALDH1A1NPSR1ESR1CA12CA9 | |
| SCHEMBL28417533 | 0.76 | ALDH1A1 (0.63) | ALDH1A1SMN1; SMN2TSHRESR1CA12 | |
| SCHEMBL8192584 | 0.76 | PKM (0.44) | ALDH1A1NPSR1ESR1CA12CA9 | |
| Sulfuric Acid SCHEMBL30998027 | 0.76 | CA12 (0.41) | ALDH1A1SMN1; SMN2TSHRNPSR1ESR1 | |
| Sulfuric Acid SCHEMBL30998026 | 0.76 | CA12 (0.41) | ALDH1A1SMN1; SMN2TSHRNPSR1ESR1 | |
| SCHEMBL28498842 | 0.74 | ALDH1A1 (0.39) | ALDH1A1ESR1CA12CA9CA2 | |
| SCHEMBL9388441 | 0.74 | TSHR (0.44) | ALDH1A1TSHRESR1CA12CA9 | |
| SCHEMBL9312419 | 0.71 | ESR1 (0.46) | ALDH1A1SMN1; SMN2TSHRNPSR1ESR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1993015442-A1 | ROLLED, PRE-IMAGED SANDBLAST MASKS | THE CHROMALINE CORPORATION (US) | 1993-08-05 | — | — | WO | disclosed |
| CN-86103254-A | A kind of method for preparing the addition compound of dipeptides and amine | — | 1986-11-26 | — | — | CN | disclosed |