Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | AKT1 | P31749 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 3/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | BLM | P54132 | 1/20 | 0.30 |
| ▸ | GFER | P55789 | 1/20 | 0.30 |
| ▸ | PMP22 | Q01453 | 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 | |
|---|---|---|---|---|
| SCHEMBL11599599 | 0.73 | KDM4E (0.39) | TSHRSMN1; SMN2ALDH1A1CYP3A4LMNA | |
| SCHEMBL11652789 | 0.69 | CYP2C19 (0.43) | TSHRSMN1; SMN2ALDH1A1CYP2C19HTT | |
| SCHEMBL5729478 | 0.69 | ALDH1A1 (0.36) | TSHRALDH1A1CYP2C19HTTAKT1 | |
| SCHEMBL9818046 | 0.69 | ALDH1A1 (0.36) | TSHRALDH1A1CYP2C19HTTAKT1 | |
| SCHEMBL7403368 | 0.68 | ALDH1A1 (0.34) | TSHRALDH1A1CYP2C19HTTAKT1 | |
| SCHEMBL313108 | 0.68 | TSHR (0.48) | TSHRSMN1; SMN2ALDH1A1CYP3A4HSD11B1 | |
| SCHEMBL2363937 | 0.67 | ALDH1A1 (0.35) | TSHRALDH1A1CYP2C19LMNA | |
| SCHEMBL11649668 | 0.66 | ALDH1A1 (0.33) | TSHRALDH1A1CYP2C19LMNA | |
| SCHEMBL11652322 | 0.66 | ALDH1A1 (0.33) | TSHRALDH1A1CYP2C19LMNAMAPT | |
| Naphthalene SCHEMBL7042461 | 0.66 | ALDH1A1 (0.38) | TSHRSMN1; SMN2ALDH1A1ESR1CYP2C19 |
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-4115378-A | TEXTILES | BAYER AKTIENGESELLSCHAFT (DE) | 1978-09-19 | — | — | US | claimed |