Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 1/20 | 0.33 |
| ▸ | GRM5 | P41594 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
| ▸ | HTR2B | P41595 | 1/20 | 0.30 |
| ▸ | CHAT | P28329 | 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 | |
|---|---|---|---|---|
| SCHEMBL28001806 | 0.84 | HRH3 (0.31) | ACACBHTR2AHTR2CHTR2B | |
| SCHEMBL28476001 | 0.83 | — | — | |
| SCHEMBL27814779 | 0.82 | ALDH1A1 (0.33) | ACACBGRM5KDM4EALDH1A1GAA | |
| SCHEMBL650997 | 0.82 | KDM4E (0.32) | KDM4EHTR2AHTR2CHTR2B | |
| SCHEMBL27820573 | 0.82 | P2RY6 (0.34) | GRM5KDM4EALDH1A1GAAHTR2A | |
| SCHEMBL497591 | 0.81 | GRM5 (0.33) | GRM5KDM4EALDH1A1GAACHAT | |
| SCHEMBL15756938 | 0.81 | P2RY6 (0.34) | GRM5KDM4EALDH1A1GAAHTR2A | |
| SCHEMBL28433044 | 0.81 | GRM5 (0.33) | GRM5KDM4EALDH1A1GAACHAT | |
| SCHEMBL15667289 | 0.80 | ALDH1A1 (0.31) | ACACBGRM5KDM4EALDH1A1GAA | |
| SCHEMBL649343 | 0.80 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-103154007-A | Anthra[2,3-b:7,6b']dithiophene derivatives and their use as organic semiconductors | MERCK PATENT GMBH | 2013-06-12 | — | — | CN | disclosed |