Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.58 |
| ▸ | RAB9A | P51151 | 3/20 | 0.58 |
| ▸ | CYP11B2 | P19099 | 7/20 | 0.53 |
| ▸ | CYP11B1 | P15538 | 6/20 | 0.53 |
| ▸ | CYP17A1 | P05093 | 4/20 | 0.53 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.46 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8273166 | 0.89 | NPC1 (0.65) | NPC1RAB9ACYP11B2CYP11B1CYP17A1 | |
| SCHEMBL13409376 | 0.86 | MAPT (0.55) | NPC1RAB9ACYP11B2CYP11B1KDM4E | |
| SCHEMBL13409379 | 0.85 | PDGFRB (0.43) | NPC1RAB9ACYP17A1KDM4EALDH1A1 | |
| SCHEMBL1536354 | 0.80 | NPC1 (0.64) | NPC1RAB9ACYP11B2CYP11B1CYP17A1 | |
| SCHEMBL8352665 | 0.80 | NPC1 (0.64) | NPC1RAB9ACYP11B2CYP11B1CYP17A1 | |
| SCHEMBL13409378 | 0.79 | MAPT (0.46) | NPC1RAB9AKDM4EALDH1A1HPGD | |
| SCHEMBL13409349 | 0.78 | TRPM8 (0.49) | NPC1RAB9AALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL13409339 | 0.77 | APP (0.44) | NPC1RAB9AKDM4EALDH1A1HPGD | |
| SCHEMBL13409335 | 0.77 | MAPT (0.40) | NPC1RAB9AKDM4EALDH1A1HSD17B10 | |
| SCHEMBL13409314 | 0.75 | ACP1 (0.54) | NPC1RAB9AKDM4EALDH1A1HPGD |
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-7705146-B2 | Hepatitis C inhibitor peptide analogs | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-04-27 | — | — | US | disclosed |