Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 3/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | SLC6A2 | P23975 | 6/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.50 |
| ▸ | CHRM2 | P08172 | 5/20 | 0.50 |
| ▸ | SCN1A | P35498 | 3/20 | 0.50 |
| ▸ | SCN2A | Q99250 | 3/20 | 0.50 |
| ▸ | SCN3A | Q9NY46 | 3/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.46 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | KCNA5 | P22460 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11028250 | 0.90 | LMNA (0.56) | ALDH1A1CYP1A2LMNACYP2C19TSHR | |
| SCHEMBL1131686 | 0.82 | ALDH1A1 (0.55) | ALDH1A1CYP1A2LMNACYP2C19TSHR | |
| SCHEMBL14519738 | 0.82 | LMNA (0.49) | LMNACYP2D6 | |
| SCHEMBL11029565 | 0.80 | SLC6A2 (0.47) | LMNASLC6A2SLC6A4SLC6A3KCNA5 | |
| SCHEMBL6227388 | 0.80 | ALDH1A1 (0.53) | ALDH1A1CYP1A2LMNACYP2C19TSHR | |
| SCHEMBL11028014 | 0.79 | SLC6A2 (0.48) | ALDH1A1CYP1A2LMNACYP2C19TSHR | |
| SCHEMBL11028017 | 0.79 | SLC6A2 (0.48) | ALDH1A1CYP1A2LMNACYP2C19TSHR | |
| SCHEMBL11029621 | 0.78 | CYP1A2 (0.46) | ALDH1A1CYP1A2LMNACYP2C19TSHR | |
| SCHEMBL11031281 | 0.76 | TBXAS1 (0.52) | LMNACYP2C19SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL28280064 | 0.76 | SLC6A2 (0.57) | ALDH1A1CYP1A2LMNACYP2C19TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4477453-A | ANTISPASMODIC, ANTIHISTAMINE | UNIVABLOT (FR) | 1984-10-16 | — | — | US | claimed |
| US-4477453-A | ANTISPASMODIC, ANTIHISTAMINE | UNIVABLOT (FR) | 1984-10-16 | — | — | US | disclosed |