Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | OGA | O60502 | 1/20 | 0.41 |
| ▸ | ANXA2 | P07355 | 3/20 | 0.40 |
| ▸ | S100A10 | P60903 | 3/20 | 0.40 |
| ▸ | HTR1F | P30939 | 1/20 | 0.40 |
| ▸ | TYR | P14679 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10697869 | 1.00 | PARP1 (0.43) | PARP1ALDH1A1NPC1RAB9AMAPK1 | |
| Hydrochloric Acid SCHEMBL10704267 | 0.86 | ALDH1A1 (0.50) | PARP1ALDH1A1NPC1RAB9AMAPK1 | |
| SCHEMBL10700470 | 0.85 | PARP1 (0.43) | PARP1ALDH1A1NPC1RAB9AMAPK1 | |
| SCHEMBL10700464 | 0.85 | PARP1 (0.43) | PARP1ALDH1A1NPC1RAB9AMAPK1 | |
| SCHEMBL10696821 | 0.83 | MMP2 (0.52) | ALDH1A1NPC1RAB9AMAPK1KDM4E | |
| SCHEMBL10697725 | 0.83 | SMN1; SMN2 (0.43) | ALDH1A1NPC1RAB9AMAPK1KDM4E | |
| Water SCHEMBL10698996 | 0.80 | ALDH1A1 (0.40) | ALDH1A1MAPK1KDM4ELMNASMN1; SMN2 | |
| SCHEMBL10698628 | 0.79 | ABL1 (0.45) | ALDH1A1NPC1RAB9AMAPK1KDM4E | |
| SCHEMBL10697938 | 0.75 | TYR (0.41) | ALDH1A1NPC1RAB9AMAPK1KDM4E | |
| SCHEMBL10699522 | 0.74 | ENPP2 (0.46) | ALDH1A1NPC1RAB9AKDM4ELMNA |
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-0280873-A1 | Piperidines, medicines containing them and process for their preparation | Dr. Karl Thomae GmbH (DE) | 1988-09-07 | — | — | EP | disclosed |