Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMO | Q99835 | 1/20 | 0.46 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.38 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.38 |
| ▸ | NAMPT | P43490 | 1/20 | 0.38 |
| ▸ | NR1H4 | Q96RI1 | 6/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 6/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 3/20 | 0.37 |
| ▸ | CA2 | P00918 | 3/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8563816 | 0.83 | NAMPT (0.47) | NAMPTEPHX2GAACA1CA2 | |
| SCHEMBL27520455 | 0.80 | KMT2A (0.53) | NAMPTNR1H4EPHX2MEN1KMT2A | |
| SCHEMBL23409688 | 0.79 | HTT (0.47) | NAMPTNR1H4EPHX2GAACA1 | |
| SCHEMBL16885994 | 0.78 | KMT2A (0.54) | GAAMEN1NPC1RAB9AKMT2A | |
| SCHEMBL8562984 | 0.78 | ALDH1A1 (0.51) | GAAMEN1NPC1RAB9AKMT2A | |
| SCHEMBL8562987 | 0.78 | ALDH1A1 (0.51) | GAAMEN1NPC1RAB9AKMT2A | |
| SCHEMBL6945571 | 0.77 | HTT (0.50) | NAMPTNR1H4EPHX2GAACA1 | |
| SCHEMBL10165179 | 0.77 | NAMPT (0.56) | NAMPTNR1H4EPHX2GAACA1 | |
| SCHEMBL19682558 | 0.77 | KMT2A (0.60) | NAMPTNR1H4EPHX2GAACA1 | |
| SCHEMBL1543096 | 0.76 | MEN1 (0.54) | GAAMEN1NPC1RAB9AKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-1060778-C | Cephalosporin derivatives | HOFFMANN LA ROCHE (CH) | 2001-01-17 | — | — | CN | disclosed |
| US-5804577-A | ANTIBIOTICS | HOFFMANN-LA ROCHE INC. (US) | 1998-09-08 | — | — | US | disclosed |