Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EED | O75530 | 4/20 | 0.51 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.38 |
| ▸ | HTR1D | P28221 | 1/20 | 0.38 |
| ▸ | HTR1B | P28222 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.38 |
| ▸ | GBA1 | P04062 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | MLNR | O43193 | 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 | |
|---|---|---|---|---|
| SCHEMBL13576641 | 0.84 | EED (0.48) | EEDHRH4HRH3KCNH2 | |
| SCHEMBL27644931 | 0.84 | EED (0.48) | EEDHRH4HRH3KCNH2 | |
| SCHEMBL14609341 | 0.82 | EED (0.55) | EEDHRH4HRH3KCNH2P2RX7 | |
| SCHEMBL4247865 | 0.80 | GBA1 (0.59) | ADRA2AADRA2BADRA2CADRA1DHTR1D | |
| Hydrochloric Acid SCHEMBL7400329 | 0.79 | GBA1 (0.58) | ADRA2AADRA2BADRA2CADRA1DHTR1D | |
| SCHEMBL13576643 | 0.79 | KCNH2 (0.53) | EEDHRH4HRH3KCNH2P2RX7 | |
| SCHEMBL3158864 | 0.79 | EED (0.51) | EEDHRH4HRH3GBA1KMT2A | |
| SCHEMBL13576618 | 0.79 | KCNH2 (0.53) | EEDHRH4HRH3KCNH2P2RX7 | |
| SCHEMBL9748441 | 0.79 | EED (0.51) | EEDHRH4HRH3P2RX7GBA1 | |
| SCHEMBL3467789 | 0.79 | EED (0.51) | EEDHRH4HRH3GBA1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5190958-A | Fungicides | SHELL RESEARCH LIMITED (GB) | 1993-03-02 | — | — | US | disclosed |
| EP-0435387-A1 | Piperidine derivatives | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1991-07-03 | — | — | EP | disclosed |