Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.63 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.63 |
| ▸ | MAPT | P10636 | 3/20 | 0.60 |
| ▸ | LMNA | P02545 | 3/20 | 0.60 |
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
| ▸ | HTT | P42858 | 1/20 | 0.60 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.60 |
| ▸ | MEN1 | O00255 | 2/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | POLB | P06746 | 1/20 | 0.58 |
| ▸ | PKM | P14618 | 1/20 | 0.58 |
| ▸ | RAB9A | P51151 | 1/20 | 0.58 |
| ▸ | IL18 | Q14116 | 1/20 | 0.58 |
| ▸ | CNR1 | P21554 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.55 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.55 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL11769710 | 0.91 | SAE1 (0.54) | SAE1UBA2MAPTLMNATSHR | |
| SCHEMBL14423993 | 0.87 | CNR1 (0.62) | SAE1UBA2MAPTLMNATSHR | |
| SCHEMBL23560422 | 0.85 | MTNR1B (0.57) | MAPTHTTMEN1KMT2APOLB | |
| SCHEMBL10586715 | 0.84 | MTNR1B (0.48) | SAE1UBA2MAPTHTTMEN1 | |
| SCHEMBL14424467 | 0.84 | HDAC1 (0.60) | SAE1UBA2MAPTLMNATSHR | |
| SCHEMBL11054945 | 0.83 | MAPT (0.81) | SAE1UBA2MAPTLMNATSHR | |
| SCHEMBL14424473 | 0.83 | EPHX1 (0.64) | SAE1UBA2MAPTLMNATSHR | |
| SCHEMBL1912289 | 0.82 | CNR1 (0.65) | SAE1UBA2MAPTLMNATSHR | |
| SCHEMBL4112527 | 0.82 | SAE1 (0.71) | SAE1UBA2MAPTLMNATSHR | |
| SCHEMBL7157543 | 0.82 | EPHX1 (0.67) | SAE1UBA2HTTCNR1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7173004-B2 | Macrocyclic isoquinoline peptide inhibitors of hepatitis C virus | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-02-06 | — | — | US | disclosed |
| US-4444863-A | UREA COMPOUND | FUJI PHOTO FILM CO., LTD. (JP) | 1984-04-24 | — | — | US | disclosed |