Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.47 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.47 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28253232 | 0.86 | NPC1 (0.46) | NPC1RAB9AALDH1A1LMNAMEN1 | |
| SCHEMBL3364898 | 0.84 | NPC1 (0.52) | NPC1RAB9APTPN1PTPN6PTPN11 | |
| SCHEMBL7611509 | 0.82 | NPC1 (0.50) | NPC1RAB9APTPN1PTPN6PTPN11 | |
| SCHEMBL5761072 | 0.81 | KDM4E (0.56) | NPC1RAB9APTPN1PTPN6PTPN11 | |
| Bromide SCHEMBL20547060 | 0.81 | NPC1 (0.49) | NPC1RAB9APTPN1PTPN6PTPN11 | |
| SCHEMBL28156564 | 0.79 | NPC1 (0.47) | NPC1RAB9AMEN1KMT2ACA12 | |
| SCHEMBL12198408 | 0.79 | NPC1 (0.47) | NPC1RAB9APTPN1PTPN6PTPN11 | |
| SCHEMBL10660626 | 0.79 | TSHR (0.54) | NPC1RAB9AALDH1A1LMNAKDM4E | |
| SCHEMBL9031711 | 0.78 | TSHR (0.53) | NPC1RAB9APTPN1PTPN6PTPN11 | |
| Hydrochloric Acid SCHEMBL8159147 | 0.77 | TSHR (0.51) | NPC1RAB9APTPN1PTPN6PTPN11 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2501693-A1 | NOVEL HETEROCYCLIC ACRYLAMIDES AND THEIR USE AS PHARMACEUTICALS | FAB Pharma SAS (FR) | 2012-09-26 | — | — | EP | disclosed |
| WO-2011061214-A1 | NOVEL HETEROCYCLIC ACRYLAMIDES AND THEIR USE AS PHARMACEUTICALS | FAB PHARMA SAS (FR) | 2011-05-26 | — | — | WO | disclosed |