Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | MGAM | O43451 | 1/20 | 0.37 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.37 |
| ▸ | SI | P14410 | 1/20 | 0.37 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9726766 | 1.00 | PTGS2 (0.44) | PTGS2ALDH1A1HSD11B1GAAMGAM | |
| SCHEMBL9726773 | 1.00 | PTGS2 (0.44) | PTGS2ALDH1A1HSD11B1GAAMGAM | |
| SCHEMBL8846423 | 0.94 | ALDH1A1 (0.41) | PTGS2ALDH1A1GAAMGAMAMY1A | |
| SCHEMBL9726474 | 0.91 | CYP19A1 (0.41) | PTGS2ALDH1A1HSD11B1GAAKDM4E | |
| SCHEMBL9727011 | 0.77 | ALDH1A1 (0.51) | ALDH1A1HSD11B1GAAMGAMAMY1A | |
| SCHEMBL9726515 | 0.76 | ESR1 (0.39) | ALDH1A1SMN1; SMN2PKMRAB9A | |
| SCHEMBL9726705 | 0.70 | HMGCR (0.52) | ALDH1A1HSD11B1GAAMGAMAMY1A | |
| SCHEMBL9726697 | 0.70 | HMGCR (0.52) | ALDH1A1HSD11B1GAAMGAMAMY1A | |
| SCHEMBL9726690 | 0.70 | HMGCR (0.52) | ALDH1A1HSD11B1GAAMGAMAMY1A | |
| SCHEMBL8999117 | 0.68 | PTGS2 (0.39) | PTGS2KDM4EPOLBCYP19A1CYP11B2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4898949-A | Intermediates for the preparation of antihypercholesterolemic tetrazole compounds | BRISTOL-MYERS COMPANY (US) | 1990-02-06 | — | — | US | claimed |
| US-5110940-A | Inhibitors of 3-hydroxy-3-methylglutaryl coenzyme A reductase | BRISTOL-MYERS COMPANY (US) | 1992-05-05 | — | — | US | disclosed |
| US-5068346-A | Anticholesterol agents | BRISTOL-MYERS COMPANY (US) | 1991-11-26 | — | — | US | disclosed |
| US-4898949-A | Intermediates for the preparation of antihypercholesterolemic tetrazole compounds | BRISTOL-MYERS COMPANY (US) | 1990-02-06 | — | — | US | disclosed |