Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRAS | P01112 | 13/20 | 0.86 |
| ▸ | ESR1 | P03372 | 13/20 | 0.86 |
| ▸ | ESR2 | Q92731 | 13/20 | 0.86 |
| ▸ | TOP1 | P11387 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6809704 | 0.93 | HRAS (1.00) | HRASESR1ESR2TOP1MAPT | |
| Hydrochloric Acid SCHEMBL4618436 | 0.92 | HRAS (1.00) | HRASESR1ESR2TOP1MAPT | |
| SCHEMBL14102117 | 0.92 | HRAS (0.98) | HRASESR1ESR2TOP1MAPT | |
| SCHEMBL6178332 | 0.88 | HRAS (0.83) | HRASESR1ESR2TOP1MAPT | |
| SCHEMBL6974763 | 0.85 | HRAS (1.00) | HRASESR1ESR2TOP1MAPT | |
| SCHEMBL6177452 | 0.85 | HRAS (0.86) | HRASESR1ESR2TOP1MAPT | |
| Hydrochloric Acid SCHEMBL6974692 | 0.85 | HRAS (1.00) | HRASESR1ESR2TOP1MAPT | |
| SCHEMBL6487356 | 0.84 | HRAS (0.70) | HRASESR1ESR2TOP1MAPT | |
| SCHEMBL8179064 | 0.84 | HRAS (0.70) | HRASESR1ESR2TOP1MAPT | |
| Hydrochloric Acid SCHEMBL8227445 | 0.84 | HRAS (0.70) | HRASESR1ESR2TOP1MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1064281-B1 | BENZOHETEROCYCLIC DISTAMYCIN DERIVATIVES, PROCESS FOR PREPARING THEM, AND THEIR USE AS ANTITUMOR AGENTS | PHARMACIA ITALIA SPA (IT) | 2005-05-25 | — | — | EP | disclosed |
| US-6458768-B1 | ANTITUMOR AGENTS THAT CAN BE FORMULATED WITH A COMPOUND ALTERNATIVELY, CAN BE ADMINISTERED IN A MIXTURE OF DRUGS | PHARMACIA & UPJOHN, S.P.A. (IT) | 2002-10-01 | — | — | US | disclosed |