Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 4/20 | 0.39 |
| ▸ | HRH1 | P35367 | 4/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.34 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | DRD1 | P21728 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL12066463 | 0.82 | HTR2A (0.42) | SIGMAR1HTR2AHRH1ADRA2AKCNH2 | |
| SCHEMBL988241 | 0.82 | SIGMAR1 (0.39) | SIGMAR1HTR2AHRH1ADRA2AKCNH2 | |
| SCHEMBL903868 | 0.82 | HTR2A (0.42) | SIGMAR1HTR2AHRH1ADRA2AKCNH2 | |
| SCHEMBL3344466 | 0.82 | HTR2A (0.42) | SIGMAR1HTR2AHRH1ADRA2AKCNH2 | |
| SCHEMBL1760781 | 0.73 | OPRD1 (0.50) | SIGMAR1HTR2AHRH1ADRA2AKCNH2 | |
| SCHEMBL516288 | 0.73 | SIGMAR1 (0.45) | SIGMAR1HTR2AHRH1ADRA2AKCNH2 | |
| SCHEMBL529713 | 0.71 | SIGMAR1 (0.48) | SIGMAR1HTR2AHRH1ADRA2AKCNH2 | |
| Bromide SCHEMBL11785624 | 0.71 | OPRD1 (0.49) | SIGMAR1HTR2AHRH1ADRA2AKCNH2 | |
| SCHEMBL8092832 | 0.71 | SIGMAR1 (0.57) | SIGMAR1ADRA2AKCNH2AOC3CHRM2 | |
| SCHEMBL19889875 | 0.70 | TSHR (0.44) | SIGMAR1HTR2AHRH1ADRA2AKCNH2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1678607-A | Nitrogen-containing aromatic ring derivatives | EISAI CO LTD (JP) | 2005-10-05 | — | — | CN | claimed |
| CN-100339376-C | Nitrogen-containing aromatic ring derivatives | EISAI CO LTD (JP) | 2007-09-26 | — | — | CN | disclosed |
| CN-1678607-A | Nitrogen-containing aromatic ring derivatives | EISAI CO LTD (JP) | 2005-10-05 | — | — | CN | disclosed |