Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | G6PC1 | P35575 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8983564 | 1.00 | G6PC1 (0.47) | G6PC1ALDH1A1TSHRPTPN1MEN1 | |
| SCHEMBL8983573 | 1.00 | G6PC1 (0.47) | G6PC1ALDH1A1TSHRPTPN1MEN1 | |
| SCHEMBL12411286 | 0.85 | ALDH1A1 (0.45) | G6PC1ALDH1A1TSHRCNR2 | |
| SCHEMBL22384324 | 0.78 | KCNH2 (0.47) | CNR2 | |
| SCHEMBL437686 | 0.76 | MAOB (0.46) | G6PC1 | |
| SCHEMBL437687 | 0.76 | MAOB (0.46) | G6PC1 | |
| SCHEMBL437685 | 0.76 | MAOB (0.46) | G6PC1 | |
| SCHEMBL3472567 | 0.76 | KDM4E (0.43) | ALDH1A1 | |
| SCHEMBL12422799 | 0.76 | G6PC1 (0.49) | G6PC1ALDH1A1TSHRMEN1KMT2A | |
| SCHEMBL1173532 | 0.75 | PTPN1 (0.38) | G6PC1ALDH1A1TSHRPTPN1MEN1 |
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-5491233-A | Catalytic asymmetric reduction of trisubstituted olefins | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 1996-02-13 | — | — | US | disclosed |
| US-5442119-A | Catalytic asymmetric reduction of trisubstituted olefins | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 1995-08-15 | — | — | US | disclosed |