Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | TP53 | P04637 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | PGR | P06401 | 1/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.47 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.47 |
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | HRH1 | P35367 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | APAF1 | O14727 | 1/20 | 0.44 |
| ▸ | CASP3 | P42574 | 1/20 | 0.44 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.44 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.44 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL20421705 | 0.87 | ALDH1A1 (0.53) | ALDH1A1SMN1; SMN2TP53LMNAPGR | |
| SCHEMBL12821356 | 0.87 | ALDH1A1 (0.71) | ALDH1A1SMN1; SMN2TP53LMNAPGR | |
| SCHEMBL9869948 | 0.86 | ALDH1A1 (0.75) | ALDH1A1SMN1; SMN2TP53LMNAPGR | |
| SCHEMBL9869949 | 0.86 | ALDH1A1 (0.75) | ALDH1A1SMN1; SMN2TP53LMNAPGR | |
| SCHEMBL6623670 | 0.86 | ALDH1A1 (0.51) | ALDH1A1SMN1; SMN2TP53LMNAPGR | |
| SCHEMBL29131651 | 0.86 | ALDH1A1 (0.51) | ALDH1A1SMN1; SMN2TP53LMNAPGR | |
| SCHEMBL22406302 | 0.85 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2TP53LMNAPGR | |
| SCHEMBL31480010 | 0.85 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2TP53LMNAPGR | |
| SCHEMBL9555055 | 0.84 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2TP53LMNANPC1 | |
| SCHEMBL4674910 | 0.84 | ALDH1A1 (0.53) | ALDH1A1SMN1; SMN2TP53LMNAPGR |
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 |