Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | MITF | O75030 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | HRH1 | P35367 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.38 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4264174 | 0.87 | ESR1 (0.50) | MAPTMAPK1MEN1KMT2AGAA | |
| SCHEMBL4551139 | 0.87 | ESR1 (0.50) | MAPTMAPK1MEN1KMT2AGAA | |
| Methylpiperazine SCHEMBL4551422 | 0.86 | MAPK1 (0.47) | MAPTMAPK1MEN1KMT2ACYP3A4 | |
| Methylpiperazine SCHEMBL4565823 | 0.86 | MAPK1 (0.47) | MAPTMAPK1MEN1KMT2ACYP3A4 | |
| SCHEMBL4410435 | 0.83 | MAPT (0.35) | MAPTMAPK1MEN1KMT2AGAA | |
| Diethylamine SCHEMBL4562983 | 0.81 | MAPT (0.43) | MAPTMAPK1MEN1KMT2AGAA | |
| Diphenylamine SCHEMBL4414722 | 0.80 | ESR1 (0.44) | MAPTMAPK1MEN1KMT2AGAA | |
| SCHEMBL4277728 | 0.80 | MEN1 (0.45) | MAPTMEN1KMT2AGAAESR1 | |
| SCHEMBL4552432 | 0.78 | MAPT (0.43) | MAPTKMT2AGAACYP3A4ESR1 | |
| SCHEMBL4423144 | 0.75 | MAPT (0.49) | MAPTMEN1KMT2AGAAESR1 |
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 |