Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAGLA | Q9Y4D2 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | ALPL | P05186 | 1/20 | 0.33 |
| ▸ | PLA2G2A | P14555 | 2/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.32 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 4/20 | 0.32 |
| ▸ | SMPD1 | P17405 | 3/20 | 0.32 |
| ▸ | TSHR | P16473 | 3/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16748705 | 0.90 | TP53 (0.37) | PDE4BPDE4DTP53NPC1RAB9A | |
| SCHEMBL9915354 | 0.89 | TP53 (0.33) | DAGLAHDAC1HDAC8HDAC6MAOA | |
| SCHEMBL9915361 | 0.80 | ALPL (0.37) | DAGLAHDAC1HDAC8HDAC6MAOA | |
| SCHEMBL9915358 | 0.78 | S1PR3 (0.37) | TP53NPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL16748640 | 0.74 | SMPD1 (0.38) | ALPLPLA2G2APDE4APDE4BPDE4C | |
| SCHEMBL16065255 | 0.73 | HDAC1 (0.38) | DAGLAHDAC1HDAC8HDAC6MAOA | |
| SCHEMBL14124836 | 0.72 | DAGLA (0.41) | DAGLAHDAC1HDAC8HDAC6SMPD1 | |
| SCHEMBL16748687 | 0.71 | HPGD (0.43) | SMPD1HTTNPC1RAB9AALDH1A1 | |
| SCHEMBL16748690 | 0.71 | MAPT (0.41) | TP53SMPD1TSHRNPC1RAB9A | |
| SCHEMBL16747529 | 0.70 | XDH (0.41) | TP53TSHRALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-2646436-B1 | MONOBACTAMS | PFIZER (US) | 2015-05-27 | — | — | EP | disclosed |