Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 3/20 | 0.34 |
| ▸ | NOS1 | P29475 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | GUCY1B2 | O75343 | 2/20 | 0.32 |
| ▸ | GUCY1A2 | P33402 | 2/20 | 0.32 |
| ▸ | GUCY1A1 | Q02108 | 2/20 | 0.32 |
| ▸ | GUCY1B1 | Q02153 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.31 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | P2RX3 | P56373 | 2/20 | 0.30 |
| ▸ | P2RX2 | Q9UBL9 | 2/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL26066985 | 0.70 | NOS1 (0.43) | ALDH1A1TP53HTTCNR2NOS1 | |
| SCHEMBL26195406 | 0.70 | NOS1 (0.43) | ALDH1A1TP53HTTCNR2NOS1 | |
| SCHEMBL14151845 | 0.68 | NOS1 (0.50) | NOS1RAB9ASMN1; SMN2NPC1MEN1 | |
| SCHEMBL128024 | 0.68 | NOS1 (0.44) | ALDH1A1TP53HTTCNR2NOS1 | |
| SCHEMBL132261 | 0.68 | RAB9A (0.38) | TP53HTTCNR2NOS1RAB9A | |
| SCHEMBL126808 | 0.67 | NOS1 (0.43) | CNR2NOS1RAB9AMAPTPKM | |
| Ammonia Solution, Strong SCHEMBL28458799 | 0.67 | NOS1 (0.43) | ALDH1A1TP53HTTCNR2NOS1 | |
| SCHEMBL28265326 | 0.67 | NOS1 (0.33) | ALDH1A1TP53HTTCNR2NOS1 | |
| SCHEMBL6232989 | 0.67 | ALDH1A1 (0.37) | ALDH1A1TP53HTTNOS1RAB9A | |
| SCHEMBL9609561 | 0.66 | NOS1 (0.46) | CNR2NOS1RAB9ASMN1; SMN2NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005000309-A2 | CHEMICAL COMPOUNDS | IONIX PHARMACEUTICALS LIMITED (GB) | 2005-01-06 | — | — | WO | disclosed |