Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRAS | P01112 | 13/20 | 0.71 |
| ▸ | ESR1 | P03372 | 13/20 | 0.71 |
| ▸ | ESR2 | Q92731 | 13/20 | 0.71 |
| ▸ | TOP1 | P11387 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.49 |
| ▸ | EGFR | P00533 | 2/20 | 0.48 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.43 |
| ▸ | RAD52 | P43351 | 1/20 | 0.39 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8189969 | 0.96 | HRAS (0.67) | HRASESR1ESR2TOP1KDM4E | |
| Tallimustine SCHEMBL62279 | 0.93 | HRAS (0.82) | HRASESR1ESR2TOP1KDM4E | |
| SCHEMBL7501668 | 0.92 | HRAS (0.63) | HRASESR1ESR2TOP1KDM4E | |
| Tallimustine SCHEMBL1230144 | 0.92 | HRAS (0.82) | HRASESR1ESR2TOP1KDM4E | |
| SCHEMBL14102116 | 0.91 | HRAS (0.80) | HRASESR1ESR2TOP1KDM4E | |
| SCHEMBL7522868 | 0.91 | HRAS (0.67) | HRASESR1ESR2TOP1KDM4E | |
| SCHEMBL6487356 | 0.90 | HRAS (0.70) | HRASESR1ESR2TOP1KDM4E | |
| SCHEMBL8179064 | 0.90 | HRAS (0.70) | HRASESR1ESR2TOP1KDM4E | |
| SCHEMBL8193689 | 0.89 | HRAS (0.77) | HRASESR1ESR2TOP1KDM4E | |
| SCHEMBL8194364 | 0.89 | HRAS (0.70) | HRASESR1ESR2TOP1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-6165980-A | Distamycin derivatives, process for preparing them, and their use as antitumor and antiviral agents | PHARMACIA & UPJOHN S.P.A. (IT) | 2000-12-26 | — | — | US | disclosed |