Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 4/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | CTSD | P07339 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8637558 | 0.76 | NPC1 (0.40) | NPC1RAB9AHPGDALDH1A1LMNA | |
| SCHEMBL7425750 | 0.76 | CTSD (0.64) | NPC1RAB9AHPGDCYP2C19CYP1A2 | |
| SCHEMBL11013047 | 0.74 | NPC1 (0.52) | NPC1RAB9AHPGDCYP2C19CYP1A2 | |
| SCHEMBL8639690 | 0.71 | SMN1; SMN2 (0.43) | NPC1RAB9AHPGDPOLBCYP2C19 | |
| SCHEMBL27649297 | 0.69 | CTSD (0.51) | NPC1RAB9AHPGDPOLBCYP2C19 | |
| SCHEMBL1962854 | 0.69 | GPR35 (0.55) | NPC1RAB9AHPGDPOLBCYP3A4 | |
| SCHEMBL10542050 | 0.69 | POLB (0.41) | NPC1RAB9AHPGDPOLBCYP2C19 | |
| SCHEMBL10435791 | 0.68 | HPGD (0.54) | NPC1RAB9AHPGDPOLBCYP2C19 | |
| SCHEMBL7968179 | 0.68 | CTSD (0.60) | NPC1RAB9AHPGDCYP2C19CYP1A2 | |
| SCHEMBL10541320 | 0.67 | ALDH1A1 (0.70) | HPGDCYP2C19CYP1A2CYP3A4ALDH1A1 |
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-2006103452-A2 | IMPROVED NITROREDUCTASE ENZYMES | INNOVATA PLC (GB) | 2006-10-05 | — | — | WO | disclosed |