Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 1/20 | 0.51 |
| ▸ | BACE1 | P56817 | 1/20 | 0.51 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.50 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.44 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 2/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10656824 | 1.00 | GSK3B (0.51) | GSK3BBACE1DDB1CRBNALDH1A1 | |
| SCHEMBL10575685 | 1.00 | GSK3B (0.51) | GSK3BBACE1DDB1CRBNALDH1A1 | |
| SCHEMBL17610632 | 0.79 | TDP1 (0.46) | GSK3BBACE1DDB1CRBNALDH1A1 | |
| SCHEMBL30023288 | 0.78 | GAA (0.57) | ALDH1A1TDP1PBRM1TNKS2GAA | |
| SCHEMBL11566163 | 0.78 | TDP1 (0.52) | DDB1CRBNALDH1A1TDP1GAA | |
| SCHEMBL8142165 | 0.78 | TSHR (0.52) | ALDH1A1TDP1PBRM1TNKS2POLB | |
| SCHEMBL6277589 | 0.78 | TDP1 (0.52) | DDB1CRBNALDH1A1TDP1GAA | |
| SCHEMBL11652329 | 0.78 | GAA (0.57) | ALDH1A1TDP1PBRM1TNKS2GAA | |
| SCHEMBL11645287 | 0.78 | TDP1 (0.44) | GSK3BBACE1ALDH1A1TDP1GAA | |
| SCHEMBL30550385 | 0.77 | POLB (0.63) | ALDH1A1TDP1GAAPOLBHTR2C |
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 |
|---|---|---|---|---|---|---|---|
| US-5650519-A | Optically active 5, 5-disubstituted-3-(mono- or disubstituted amino)-2-thiohydantoin intermediates to fungicidal 2-imidazolin-5-ones | RHONE-POULENC AGROCHIMIE (FR) | 1997-07-22 | — | — | US | disclosed |