Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.47 |
| ▸ | XBP1 | P17861 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.43 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 5/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7644626 | 0.86 | DRD2 (0.43) | SMN1; SMN2NPSR1MAPTALOX12RAB9A | |
| SCHEMBL7646586 | 0.80 | MAPT (0.50) | SMN1; SMN2NPSR1MTNR1AMTNR1BMAPT | |
| SCHEMBL7981937 | 0.78 | MAOA (0.54) | SMN1; SMN2NPSR1MAPTALOX12RAB9A | |
| SCHEMBL7637941 | 0.75 | GAA (0.48) | SMN1; SMN2MAPTALOX12LMNAALDH1A1 | |
| SCHEMBL7979005 | 0.74 | ALDH1A1 (0.55) | SMN1; SMN2MAPTRAB9ALMNANPC1 | |
| SCHEMBL7594773 | 0.71 | MAPT (0.52) | SMN1; SMN2MAPTALOX12RAB9ALMNA | |
| SCHEMBL7599729 | 0.71 | RAB9A (0.51) | SMN1; SMN2MAPTALOX12RAB9ALMNA | |
| SCHEMBL7661945 | 0.70 | HTT (0.38) | SMN1; SMN2NPSR1MAPTALOX12RAB9A | |
| SCHEMBL7641142 | 0.70 | NPC1 (0.58) | SMN1; SMN2XBP1MAPTALOX12RAB9A | |
| SCHEMBL7642827 | 0.70 | ALDH1A1 (0.53) | SMN1; SMN2MAPTALOX12RAB9ALMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-6197803-B1 | VIRICIDES; PREVENTION REPRODUCTION | AMERICAN HOME PRODUCTS CORPORATION | 2001-03-06 | — | — | US | disclosed |