Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11245520 | 0.89 | ALDH1A1 (0.33) | ALDH1A1POLBCHRM2CHRM4CHRM1 | |
| SCHEMBL26261362 | 0.77 | TSHR (0.50) | ALDH1A1POLBCHRM1TSHR | |
| SCHEMBL11234753 | 0.76 | CHRM2 (0.31) | ALDH1A1POLBCHRM2CHRM4CHRM1 | |
| SCHEMBL30259978 | 0.73 | CHRNB2 (0.37) | ALDH1A1POLB | |
| SCHEMBL29524977 | 0.72 | ALDH1A1 (0.41) | ALDH1A1POLBTSHR | |
| SCHEMBL11230779 | 0.72 | ALDH1A1 (0.32) | ALDH1A1POLBCHRM2CHRM4CHRM1 | |
| SCHEMBL15703162 | 0.71 | RAB9A (0.43) | ALDH1A1POLBTSHR | |
| SCHEMBL3310770 | 0.70 | SMN1; SMN2 (0.57) | ALDH1A1POLBTSHR | |
| SCHEMBL14243237 | 0.70 | ALDH1A1 (0.49) | ALDH1A1POLBCHRM2CHRM4CHRM1 | |
| SCHEMBL11643646 | 0.69 | ALDH1A1 (0.44) | ALDH1A1POLBCHRM2CHRM4CHRM1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4320137-A | Derivatives of perhydro-aza-heterocycles | CIBA-GEIGY CORPORATION (US) | 1982-03-16 | — | — | US | disclosed |
| US-4246269-A | Antidepressant piperidinones | CIBA-GEIGY CORPORATION (US) | 1981-01-20 | — | — | US | disclosed |
| US-4160837-A | ANTIDEPRESSANTS | CIBA-GEIGY CORPORATION (US) | 1979-07-10 | — | — | US | disclosed |