Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 6/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.35 |
| ▸ | MAOB | P27338 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 4/20 | 0.35 |
| ▸ | HPGD | P15428 | 4/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.35 |
| ▸ | GAPDH | P04406 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.35 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MIF | P14174 | 6/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | GLA | P06280 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3396561 | 0.73 | RAB9A (0.66) | ESR2RAB9AALDH1A1KDM4EMAOB | |
| SCHEMBL16720439 | 0.72 | QPCT (0.50) | ALDH1A1KDM4EMAPTMEN1KMT2A | |
| SCHEMBL3400256 | 0.71 | GAPDH (0.55) | ESR2RAB9AALDH1A1KDM4EMAOB | |
| SCHEMBL3398092 | 0.70 | GPR35 (0.48) | ESR2RAB9AALDH1A1KDM4EMAOB | |
| SCHEMBL27601236 | 0.69 | QPCT (0.41) | RAB9AALDH1A1KDM4ENPC1HPGD | |
| SCHEMBL6928197 | 0.69 | RAB9A (0.73) | RAB9AALDH1A1KDM4ENPC1HPGD | |
| SCHEMBL5757411 | 0.68 | MEN1 (0.40) | RAB9AALDH1A1KDM4ENPC1HPGD | |
| SCHEMBL8671614 | 0.68 | QPCT (0.38) | RAB9AALDH1A1KDM4ENPC1HPGD | |
| SCHEMBL5756878 | 0.67 | QPCT (0.40) | RAB9AALDH1A1KDM4ENPC1HPGD | |
| SCHEMBL6931520 | 0.67 | MAPT (0.72) | RAB9AALDH1A1KDM4EMAOBNPC1 |
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-6566355-B1 | Useful in combination with beta -lactam antibiotics in the control of beta -lactamase forming pathogens | HOFFMANN-LA ROCHE INC. | 2003-05-20 | — | — | US | disclosed |
| US-5510343-A | BETA-LACTAMASE INHIBITOR | HOFFMANN-LA ROCHE INC. (US) | 1996-04-23 | — | — | US | disclosed |