Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.68 |
| ▸ | ACHE | P22303 | 1/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.65 |
| ▸ | CES2 | O00748 | 1/20 | 0.64 |
| ▸ | CES1 | P23141 | 1/20 | 0.64 |
| ▸ | MAPT | P10636 | 4/20 | 0.63 |
| ▸ | NPC1 | O15118 | 1/20 | 0.63 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.63 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.63 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.63 |
| ▸ | TP53 | P04637 | 1/20 | 0.62 |
| ▸ | MEN1 | O00255 | 2/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.55 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.53 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.53 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL181572 | 0.89 | CES2 (0.78) | TSHRALDH1A1CES2CES1MAPT | |
| SCHEMBL961431 | 0.89 | ALDH1A1 (0.63) | TSHRACHEALDH1A1CES2CES1 | |
| SCHEMBL8962468 | 0.88 | CES2 (0.75) | TSHRALDH1A1CES2CES1MAPT | |
| Methyl Alcohol SCHEMBL27717832 | 0.85 | TP53 (0.69) | TSHRALDH1A1CES2CES1MAPT | |
| SCHEMBL11593026 | 0.84 | CES2 (0.76) | TSHRALDH1A1CES2CES1CYP3A4 | |
| SCHEMBL333455 | 0.84 | TP53 (0.73) | TSHRALDH1A1CES2CES1MAPT | |
| SCHEMBL7787691 | 0.84 | ALDH1A1 (0.74) | TSHRALDH1A1CES2CES1MAPT | |
| Methylamine SCHEMBL27764628 | 0.83 | TP53 (0.67) | TSHRALDH1A1CES2CES1MAPT | |
| Chloromethane SCHEMBL27475705 | 0.83 | TP53 (0.67) | TSHRALDH1A1CES2CES1MAPT | |
| Acetic Acid SCHEMBL27609961 | 0.83 | ALDH1A1 (0.70) | TSHRALDH1A1CES2CES1MAPT |
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-4783472-A | 1H,3H-pyrrol[1,2-c]thiazole derivatives and pharmaceutical compositions containing them | RHONE-POULENC SANTE (FR) | 1988-11-08 | — | — | US | disclosed |