Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.47 |
| ▸ | BRD4 | O60885 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.46 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.45 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8156424 | 0.86 | CYP2C19 (0.58) | CYP2C19ALDH1A1GAAKMT2AMEN1 | |
| SCHEMBL8151504 | 0.85 | CYP2C19 (0.63) | CYP2C19ALDH1A1HTTGAAKMT2A | |
| SCHEMBL8162444 | 0.85 | CYP2C19 (0.63) | CYP2C19ALDH1A1HTTGAAKMT2A | |
| SCHEMBL8161528 | 0.85 | CYP2C19 (0.63) | CYP2C19ALDH1A1HTTGAAKMT2A | |
| SCHEMBL8157306 | 0.85 | CYP2C19 (0.63) | CYP2C19ALDH1A1HTTGAAKMT2A | |
| SCHEMBL9066391 | 0.85 | GAA (0.58) | CYP2C19HTTGAASRD5A2ADRA1D | |
| SCHEMBL8162692 | 0.85 | CYP2C19 (0.63) | CYP2C19ALDH1A1HTTGAAKMT2A | |
| SCHEMBL8157994 | 0.85 | CYP2C19 (0.63) | CYP2C19ALDH1A1HTTGAAKMT2A | |
| SCHEMBL8150957 | 0.85 | CYP2C19 (0.63) | CYP2C19ALDH1A1HTTGAAKMT2A | |
| SCHEMBL8163669 | 0.85 | CYP2C19 (0.63) | CYP2C19ALDH1A1HTTGAAKMT2A |
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-2011047323-A2 | ANTIMICROBIAL COMPOUNDS AND METHODS OF MAKING AND USING THE SAME | RIB-X PHARMACEUTICALS, INC. (US) | 2011-04-21 | — | — | WO | disclosed |