Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | MITF | O75030 | 1/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | ESR1 | P03372 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | RXRA | P19793 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.36 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.36 |
| ▸ | APEX1 | P27695 | 2/20 | 0.36 |
| ▸ | PTAFR | P25105 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL4271682 | 1.00 | RAB9A (0.46) | RAB9AMITFHSP90AA1MAPTESR1 | |
| SCHEMBL4263449 | 0.83 | ESR1 (0.49) | RAB9AMAPTESR1GAAMEN1 | |
| SCHEMBL4263444 | 0.83 | ESR1 (0.49) | RAB9AMAPTESR1GAAMEN1 | |
| SCHEMBL4412530 | 0.83 | MAPT (0.43) | RAB9AHSP90AA1MAPTESR1GAA | |
| SCHEMBL4412532 | 0.83 | MAPT (0.43) | RAB9AHSP90AA1MAPTESR1GAA | |
| SCHEMBL4264174 | 0.81 | ESR1 (0.50) | RAB9AMITFHSP90AA1MAPTESR1 | |
| SCHEMBL4551139 | 0.81 | ESR1 (0.50) | RAB9AMITFHSP90AA1MAPTESR1 | |
| SCHEMBL4410195 | 0.80 | MAPT (0.41) | MAPTESR1GAAMEN1KMT2A | |
| SCHEMBL4410193 | 0.80 | MAPT (0.41) | MAPTESR1GAAMEN1KMT2A | |
| Diethylamine SCHEMBL4562983 | 0.75 | MAPT (0.43) | RAB9AMITFHSP90AA1MAPTESR1 |
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-2009110002-A1 | NOVEL EFFLUX PUMP INHIBITORS | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2009-09-11 | — | — | WO | disclosed |