Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ICAM1 | P05362 | 6/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.31 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
| ▸ | HRH1 | P35367 | 1/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7180856 | 0.81 | ICAM1 (0.42) | ICAM1HDAC6ALDH1A1CHRM2HTR1A | |
| SCHEMBL8522771 | 0.79 | ICAM1 (0.43) | ICAM1HDAC6KDM4ENPC1ALDH1A1 | |
| SCHEMBL6747555 | 0.74 | HDAC6 (0.44) | ICAM1HDAC6ALDH1A1LMNAHRH1 | |
| SCHEMBL7144340 | 0.74 | HDAC6 (0.42) | HDAC6LMNASMN1; SMN2CHRM2HTR1A | |
| SCHEMBL8315505 | 0.73 | HDAC6 (0.45) | HDAC6ALDH1A1LMNASMN1; SMN2CHRM2 | |
| SCHEMBL6745150 | 0.73 | HDAC6 (0.44) | HDAC6KDM4EALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL6747463 | 0.73 | HDAC6 (0.44) | HDAC6ALDH1A1LMNASMN1; SMN2CHRM2 | |
| SCHEMBL8322460 | 0.71 | ICAM1 (0.40) | ICAM1HDAC6KCNH2 | |
| SCHEMBL6747320 | 0.70 | HDAC6 (0.57) | HDAC6 | |
| SCHEMBL6746495 | 0.69 | HDAC6 (0.43) | HDAC6KDM4ENPC1ALDH1A1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0934941-A1 | BENZOPIPERIDINE DERIVATIVES | Eisai Co., Ltd. (JP) | 1999-08-11 | — | — | EP | disclosed |