Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSTO1 | P78417 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.35 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL21844937 | 0.86 | GSTO1 (0.39) | GSTO1KMT2AMEN1HTTKDM4E | |
| SCHEMBL21844846 | 0.80 | MDM2 (0.42) | KMT2AMEN1HTTTSHRKDM4E | |
| SCHEMBL15076699 | 0.79 | GSTO1 (0.55) | GSTO1KMT2AMEN1HTTKDM4E | |
| SCHEMBL15076789 | 0.75 | GSTO1 (0.53) | GSTO1KMT2AMEN1HTTTSHR | |
| SCHEMBL21844941 | 0.74 | GBA1 (0.43) | KMT2AMEN1HTTTSHRKDM4E | |
| SCHEMBL15076741 | 0.74 | GSTO1 (0.63) | GSTO1KMT2AMEN1HTTTSHR | |
| SCHEMBL18947632 | 0.72 | GSTO1 (0.53) | GSTO1KMT2AMEN1HTTLMNA | |
| SCHEMBL18947638 | 0.71 | GSTO1 (0.52) | GSTO1KMT2AMEN1HTTTSHR | |
| SCHEMBL20083954 | 0.71 | MAPT (0.41) | HTTPKMLMNASMN1; SMN2MAPT | |
| SCHEMBL18948579 | 0.70 | KMT2A (0.40) | GSTO1KMT2AMEN1KDM4EALDH1A1 |
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-9676747-B2 | Hepatitis B antiviral agents | NOVIRA THERAPEUTICS, INC. (US) | 2017-06-13 | — | — | US | disclosed |