Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.45 |
| ▸ | CDK1 | P06493 | 3/20 | 0.44 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | CTSL | P07711 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.41 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.41 |
| ▸ | CDK4 | P11802 | 1/20 | 0.41 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30410484 | 0.94 | NPC1 (0.60) | NPC1RAB9ASMN1; SMN2ADORA3ADORA1 | |
| SCHEMBL30410572 | 0.93 | NPC1 (0.59) | NPC1RAB9ASMN1; SMN2ADORA3ADORA1 | |
| SCHEMBL30411079 | 0.92 | NPC1 (0.53) | NPC1RAB9ASMN1; SMN2ADORA3ADORA1 | |
| SCHEMBL30410355 | 0.90 | NPC1 (0.51) | NPC1RAB9ASMN1; SMN2ADORA3ADORA1 | |
| SCHEMBL30410705 | 0.90 | NPC1 (0.51) | NPC1RAB9ASMN1; SMN2ADORA3ADORA1 | |
| SCHEMBL30410752 | 0.90 | ADORA3 (0.52) | NPC1RAB9ASMN1; SMN2ADORA3ADORA1 | |
| SCHEMBL30410654 | 0.90 | CTSL (0.54) | NPC1RAB9ASMN1; SMN2ADORA3ADORA1 | |
| SCHEMBL30410990 | 0.90 | NPC1 (0.51) | NPC1RAB9ASMN1; SMN2ADORA3ADORA1 | |
| SCHEMBL30410406 | 0.89 | NPC1 (0.63) | NPC1RAB9ASMN1; SMN2ADORA3ADORA1 | |
| SCHEMBL30410745 | 0.88 | ADORA3 (0.53) | NPC1RAB9ASMN1; SMN2ADORA3ADORA1 |
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-4178959-A1 | NITROGEN HETEROCYCLIC CYTOKININ DERIVATIVES, COMPOSITIONS CONTAINING THESE DERIVATIVES AND USE THEREOF | Univerzita Palackého v Olomouci (CZ) | 2023-05-17 | — | — | EP | disclosed |