Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | APEX1 | P27695 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | THPO | P40225 | 1/20 | 0.47 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.47 |
| ▸ | CNR1 | P21554 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1459777 | 0.85 | NPC1 (0.43) | NPC1RAB9AMAPTKDM4EALDH1A1 | |
| SCHEMBL23618778 | 0.85 | UHRF1 (0.47) | NPC1RAB9AMAPTKDM4EALDH1A1 | |
| SCHEMBL30992044 | 0.85 | UHRF1 (0.47) | NPC1RAB9AMAPTKDM4EALDH1A1 | |
| SCHEMBL23343417 | 0.85 | MAPT (0.43) | NPC1RAB9AMAPTKDM4EALDH1A1 | |
| SCHEMBL30108322 | 0.83 | MAPT (0.42) | NPC1RAB9AMAPTKDM4EALDH1A1 | |
| SCHEMBL15417325 | 0.83 | RAB9A (0.42) | NPC1RAB9AMAPTKDM4EALDH1A1 | |
| SCHEMBL17553883 | 0.83 | NOS3 (0.49) | NPC1RAB9AMAPTKDM4EALDH1A1 | |
| SCHEMBL24956360 | 0.82 | HPGDS (0.43) | NPC1RAB9AMAPTKDM4EALDH1A1 | |
| SCHEMBL30108286 | 0.82 | MAPT (0.41) | NPC1RAB9AMAPTKDM4EALDH1A1 | |
| SCHEMBL19249055 | 0.81 | BAZ2B (0.42) | NPC1RAB9AMAPTKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2651899-B1 | SUBSTITUTED 6,6-FUSED NITROGENOUS HETEROCYCLIC COMPOUNDS AND USES THEREOF | HOFFMANN LA ROCHE (CH) | 2017-05-31 | — | — | EP | disclosed |
| US-8623889-B2 | Substituted 6,6-fused nitrogenous heterocyclic compounds and uses thereof | GENENTECH, INC. (US) | 2014-01-07 | — | — | US | disclosed |