Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.56 |
| ▸ | RAB9A | P51151 | 3/20 | 0.56 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.49 |
| ▸ | TP53 | P04637 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | MMP1 | P03956 | 1/20 | 0.47 |
| ▸ | MMP9 | P14780 | 1/20 | 0.47 |
| ▸ | MMP13 | P45452 | 1/20 | 0.47 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8186450 | 1.00 | NPC1 (0.56) | NPC1RAB9AS1PR5ALDH1A1MEN1 | |
| SCHEMBL8195157 | 0.89 | HRH3 (0.54) | NPC1RAB9AS1PR5HRH3TP53 | |
| SCHEMBL8195224 | 0.89 | HRH3 (0.54) | NPC1RAB9AS1PR5HRH3TP53 | |
| SCHEMBL10287516 | 0.84 | CCR3 (0.63) | ALDH1A1MEN1KMT2AMAPK1TSHR | |
| SCHEMBL5258408 | 0.80 | OPRL1 (0.71) | NPC1RAB9AALDH1A1MEN1KMT2A | |
| SCHEMBL8261399 | 0.79 | CHRM4 (0.47) | NPC1RAB9AALDH1A1MAPK1TSHR | |
| SCHEMBL8194978 | 0.77 | YAP1 (0.49) | — | |
| SCHEMBL8194760 | 0.77 | YAP1 (0.49) | — | |
| SCHEMBL17028504 | 0.73 | OPRL1 (0.51) | ALDH1A1MEN1KMT2AMAPK1TSHR | |
| SCHEMBL18309948 | 0.73 | OPRL1 (0.51) | ALDH1A1MEN1KMT2AMAPK1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000063173-A1 | PROCESS FOR THE PREPARATION OF SUBSTITUTED PIPERIDINES | F. HOFFMANN-LA ROCHE AG (CH) | 2000-10-26 | — | — | WO | disclosed |