Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.58 |
| ▸ | RAB9A | P51151 | 4/20 | 0.58 |
| ▸ | TP53 | P04637 | 2/20 | 0.58 |
| ▸ | PKM | P14618 | 1/20 | 0.58 |
| ▸ | GAA | P10253 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | POLB | P06746 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL27509166 | 1.00 | NPC1 (0.58) | NPC1RAB9ATP53PKMGAA | |
| SCHEMBL27509893 | 1.00 | NPC1 (0.58) | NPC1RAB9ATP53PKMGAA | |
| SCHEMBL27557417 | 0.84 | GAA (0.51) | NPC1RAB9ATP53PKMGAA | |
| SCHEMBL27492954 | 0.83 | F2 (0.53) | NPC1RAB9ATP53PKMGAA | |
| SCHEMBL27495702 | 0.81 | DRD2 (0.42) | NPC1RAB9ATP53PKMGAA | |
| SCHEMBL27494111 | 0.81 | DRD2 (0.42) | NPC1RAB9ATP53PKMGAA | |
| SCHEMBL27492956 | 0.81 | DRD2 (0.42) | NPC1RAB9ATP53PKMGAA | |
| SCHEMBL27511351 | 0.76 | ALDH1A1 (0.50) | NPC1RAB9APKMGAASMN1; SMN2 | |
| SCHEMBL27495316 | 0.76 | TDO2 (0.42) | NPC1RAB9ATP53PKMGAA | |
| SCHEMBL27495706 | 0.76 | LMNA (0.42) | NPC1RAB9ATP53PKMGAA |
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 |
|---|---|---|---|---|---|---|---|
| CN-1223650-A | Piperidines and pyrrolidines | MERCK PATENT GMBH (DE) | 1999-07-21 | — | — | CN | disclosed |