Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMPD1 | P17405 | 2/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.45 |
| ▸ | NAMPT | P43490 | 2/20 | 0.44 |
| ▸ | NAAA | Q02083 | 1/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.44 |
| ▸ | MGLL | Q99685 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.42 |
| ▸ | TACR3 | P29371 | 1/20 | 0.42 |
| ▸ | DHODH | Q02127 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13188614 | 0.89 | CYP19A1 (0.48) | SMPD1HDAC1HDAC3KCNH2HDAC2 | |
| SCHEMBL13188516 | 0.87 | SMPD1 (0.50) | SMPD1HDAC1HDAC3HDAC2HDAC6 | |
| SCHEMBL13188633 | 0.86 | SMPD1 (0.47) | SMPD1HDAC1HDAC3HDAC2HDAC6 | |
| SCHEMBL13188377 | 0.85 | WNT3A (0.49) | SMPD1HDAC6POLBLMNAKMT2A | |
| SCHEMBL13188413 | 0.85 | SMPD1 (0.45) | SMPD1HDAC1HDAC3HDAC2NAMPT | |
| SCHEMBL13188617 | 0.82 | HDAC6 (0.50) | SMPD1HDAC1HDAC3HDAC2HDAC6 | |
| SCHEMBL13187833 | 0.81 | ADORA3 (0.53) | SMPD1HDAC1HDAC3HDAC2HDAC6 | |
| SCHEMBL13188800 | 0.81 | HDAC1 (0.55) | SMPD1HDAC1HDAC3HDAC2HDAC6 | |
| SCHEMBL13188875 | 0.80 | MKNK1 (0.55) | SMPD1HDAC1HDAC3HDAC2NAMPT | |
| SCHEMBL13187746 | 0.80 | DEGS1 (0.60) | SMPD1HDAC1HDAC3HDAC2NAMPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010100475-A1 | HYDROXAMIC ACID DERIVATIVES AS GRAM-NEGATIVE ANTIBACTERIAL AGENTS | ASTRAZENECA AB (SE) | 2010-09-10 | — | — | WO | disclosed |