Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11068033 | 1.00 | ALDH1A1 (0.40) | ALDH1A1TSHRMAPK1KDM4ESMN1; SMN2 | |
| SCHEMBL8172574 | 0.78 | ALDH1A1 (0.39) | ALDH1A1TSHRMAPK1KDM4ESMN1; SMN2 | |
| SCHEMBL2209517 | 0.76 | — | — | |
| SCHEMBL9416746 | 0.75 | ALDH1A1 (0.39) | ALDH1A1TSHRTDP1 | |
| SCHEMBL11016159 | 0.73 | ALDH1A1 (0.39) | ALDH1A1TSHRMAPK1KDM4ESMN1; SMN2 | |
| SCHEMBL11670290 | 0.72 | — | — | |
| SCHEMBL11000228 | 0.72 | — | — | |
| SCHEMBL1925477 | 0.72 | — | — | |
| SCHEMBL1359748 | 0.72 | — | — | |
| SCHEMBL14712444 | 0.70 | ALDH1A1 (0.40) | ALDH1A1TSHRMAPK1KDM4ESMN1; SMN2 |
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-4436661-A | INTERMEDIATES FOR PENICILLIN ANTIBIOTICS | CIBA-GEIGY CORPORATION (US) | 1984-03-13 | — | — | US | disclosed |
| US-4431588-A | PENACILLINS | CIBA-GEIGY CORPORATION (US) | 1984-02-14 | — | — | US | disclosed |