Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 6/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | NPC1 | O15118 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | ATM | Q13315 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | MGLL | Q99685 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.32 |
| ▸ | HTR3B | O95264 | 1/20 | 0.32 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL698253 | 0.80 | KDM4E (0.43) | NOTUMMAPTNPC1KDM4ERAB9A | |
| SCHEMBL28391759 | 0.76 | IDO1 (0.35) | — | |
| SCHEMBL29029805 | 0.67 | HSP90AA1 (0.41) | MAPTNPC1KDM4ERAB9AKMT2A | |
| SCHEMBL2903090 | 0.65 | NOTUM (0.48) | NOTUMMAPTNPC1KDM4ERAB9A | |
| SCHEMBL29029793 | 0.65 | NOTUM (0.39) | NOTUMMAPTNPC1KDM4ERAB9A | |
| SCHEMBL698795 | 0.63 | NPC1 (0.45) | NOTUMMAPTNPC1KDM4ERAB9A | |
| SCHEMBL11071665 | 0.61 | HTR3E (0.41) | NOTUMMAPTNPC1KDM4ERAB9A | |
| SCHEMBL344002 | 0.61 | NOTUM (0.48) | NOTUMMAPTNPC1KDM4ERAB9A | |
| SCHEMBL9804027 | 0.60 | NOTUM (0.42) | NOTUMMAPTNPC1RAB9AMEN1 | |
| SCHEMBL970720 | 0.60 | NOTUM (0.38) | NOTUMMAPTNPC1RAB9AF2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116406359-A | Bicyclo [1.1.1] pentanes for the treatment and prevention of hepatitis B virus infection | 豪夫迈·罗氏有限公司 | 2023-07-07 | — | — | CN | claimed |
| CN-116406359-A | Bicyclo [1.1.1] pentanes for the treatment and prevention of hepatitis B virus infection | 豪夫迈·罗氏有限公司 | 2023-07-07 | — | — | CN | disclosed |