Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | GPR3 | P46089 | 5/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | SCN4A | P35499 | 2/20 | 0.41 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.41 |
| ▸ | GMNN | O75496 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 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 | |
|---|---|---|---|---|
| SCHEMBL15147553 | 0.82 | GAA (0.47) | GAAALDH1A1POLBTHRBGPR3 | |
| SCHEMBL2366206 | 0.80 | PDE2A (0.44) | GAAGPR3NPC1RAB9ASCN4A | |
| SCHEMBL31423218 | 0.79 | NPC1 (0.47) | GAAGPR3NPC1RAB9ASCN4A | |
| SCHEMBL16955162 | 0.76 | GPR3 (0.42) | GAAGPR3NPC1RAB9ASCN4A | |
| SCHEMBL16953635 | 0.76 | GPR3 (0.42) | GAAALDH1A1POLBTHRBGPR3 | |
| SCHEMBL16959108 | 0.76 | CYP1A1 (0.44) | GPR3CYP1A2NFKB1RUNX1 | |
| SCHEMBL16950613 | 0.75 | GPR3 (0.41) | GAAALDH1A1POLBTHRBGPR3 | |
| SCHEMBL16958727 | 0.75 | GPR3 (0.45) | GAAGPR3NPC1RAB9ASCN4A | |
| SCHEMBL6205088 | 0.75 | GPR3 (0.41) | GAAALDH1A1GPR3NPC1RAB9A | |
| SCHEMBL15718212 | 0.73 | GPR3 (0.46) | GAAALDH1A1POLBTHRBGPR3 |
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 |
|---|---|---|---|---|---|---|---|
| US-6071927-A | Spiro-piperidine derivatives and their use as therapeutic agents | MERCK SHARP & DOHME LTD. (GB) | 2000-06-06 | — | — | US | disclosed |
| CN-1223656-A | Spiro-piperidine derivatives and their use as therapeutic agents | MERCK SHARP & DOHME (GB) | 1999-07-21 | — | — | CN | disclosed |