Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.35 |
| ▸ | TP53 | P04637 | 4/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.35 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.35 |
| ▸ | PSIP1 | O75475 | 2/20 | 0.34 |
| ▸ | COMT | P21964 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.31 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.31 |
| ▸ | SDHB | P21912 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10872794 | 0.80 | NPSR1 (0.44) | MAPTTP53SMN1; SMN2THRBMEN1 | |
| SCHEMBL27733018 | 0.80 | PSIP1 (0.34) | MAPTPSIP1COMTLMNAGAA | |
| SCHEMBL30744221 | 0.78 | TSHR (0.34) | MAPTTP53SMN1; SMN2THRBMEN1 | |
| SCHEMBL16232098 | 0.76 | SDHB (0.37) | MAPTTP53SMN1; SMN2THRBMEN1 | |
| SCHEMBL10727966 | 0.73 | COMT (0.43) | MAPTTP53SMN1; SMN2THRBKMT2A | |
| SCHEMBL1750195 | 0.71 | PARP1 (0.38) | MAPTTP53SMN1; SMN2MEN1NPC1 | |
| SCHEMBL27868514 | 0.70 | HSP90AA1 (0.54) | NPC1RAB9ALMNAKDM4E | |
| SCHEMBL19422050 | 0.69 | HSP90AA1 (0.37) | MAPTNPC1KMT2APSIP1COMT | |
| SCHEMBL16608855 | 0.68 | LMNA (0.37) | SMN1; SMN2THRBPSIP1LMNAGAA | |
| SCHEMBL2643226 | 0.68 | PSIP1 (0.34) | PSIP1COMTGAAKDM4E |
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-2015048246-A1 | TETRA-ARYL CYCLOBUTANE INHIBITORS OF ANDROGEN RECEPTOR ACTION FOR THE TREATMENT OF HORMONE REFRACTORY CANCER | THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) | 2015-04-02 | — | — | WO | disclosed |