Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | MGAM | O43451 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | SI | P14410 | 1/20 | 0.30 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.30 |
| ▸ | SOAT1 | P35610 | 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 | |
|---|---|---|---|---|
| SCHEMBL315108 | 0.89 | CHRM1 (0.35) | ATMALDH1A1LMNACYP2C19TSHR | |
| Ether SCHEMBL4967124 | 0.79 | MEN1 (0.32) | ALDH1A1HSD17B10TSHR | |
| SCHEMBL10942237 | 0.76 | GAA (0.41) | ATMALDH1A1LMNASMN1; SMN2HTT | |
| SCHEMBL9633535 | 0.75 | FFAR3 (0.38) | ALDH1A1LMNATSHR | |
| SCHEMBL10925798 | 0.73 | CA2 (0.38) | ALDH1A1LMNATSHR | |
| Trichloroacetic Acid SCHEMBL10540554 | 0.72 | ALDH1A1 (0.56) | ALDH1A1LMNACYP2C19HSD17B10TSHR | |
| SCHEMBL5188446 | 0.71 | CHRM1 (0.37) | — | |
| Dalapon SCHEMBL5693111 | 0.70 | ALDH1A1 (0.38) | ALDH1A1LMNACYP2C19HSD17B10TSHR | |
| Dichloroacetic Acid SCHEMBL7260885 | 0.70 | LMNA (0.53) | ALDH1A1LMNACYP3A4CYP2C9CYP2C19 | |
| SCHEMBL28656014 | 0.70 | ALDH1A1 (0.37) | ALDH1A1HSD17B10ALOX15 |
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-4360531-A | Substituted cycloalkanes | THE UPJOHN COMPANY (US) | 1982-11-23 | — | — | US | disclosed |