Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.54 |
| ▸ | GAA | P10253 | 2/20 | 0.54 |
| ▸ | CNR1 | P21554 | 1/20 | 0.51 |
| ▸ | CNR2 | P34972 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL16596340 | 1.00 | LMNA (0.54) | LMNAL3MBTL1GAACNR1CNR2 | |
| SCHEMBL18332927 | 1.00 | LMNA (0.54) | LMNAL3MBTL1GAACNR1CNR2 | |
| SCHEMBL18332921 | 0.99 | LMNA (0.55) | LMNAL3MBTL1GAACNR1CNR2 | |
| SCHEMBL16596237 | 0.96 | LMNA (0.59) | LMNAL3MBTL1GAAMAPTALDH1A1 | |
| SCHEMBL16596262 | 0.89 | L3MBTL1 (0.51) | LMNAL3MBTL1GAAMAPTALDH1A1 | |
| SCHEMBL18328514 | 0.87 | L3MBTL1 (0.56) | LMNAL3MBTL1GAACNR1CNR2 | |
| SCHEMBL18328515 | 0.87 | L3MBTL1 (0.56) | LMNAL3MBTL1GAACNR1CNR2 | |
| SCHEMBL18328481 | 0.87 | L3MBTL1 (0.56) | LMNAL3MBTL1GAACNR1CNR2 | |
| SCHEMBL18328513 | 0.86 | L3MBTL1 (0.57) | LMNAL3MBTL1GAACNR1CNR2 | |
| SCHEMBL16596200 | 0.85 | CNR1 (0.53) | LMNAL3MBTL1GAACNR1CNR2 |
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-9751851-B2 | Molecules and compositions that inhibit gram negative bacteria and their uses | THE TRUSTEES OF PRINCETON UNIVERSITY (US) | 2017-09-05 | — | — | US | disclosed |
| WO-2015042363-A1 | MOLECULES AND COMPOSITIONS THAT INHIBIT GRAM NEGATIVE BACTERIA AND THEIR USES | THE TRUSTEES OF PRINCETON UNIVERSITY (US) | 2015-03-26 | — | — | WO | disclosed |