Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | BCL9 | O00512 | 1/20 | 0.50 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | CRHBP | P24387 | 1/20 | 0.45 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.45 |
| ▸ | MGLL | Q99685 | 2/20 | 0.45 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL25863 | 0.89 | HTR2A (0.53) | HTR2AGAABCL9CTNNB1MAPT | |
| SCHEMBL409598 | 0.88 | HTR2A (0.59) | HTR2AGAABCL9CTNNB1MAPT | |
| SCHEMBL30967402 | 0.88 | HTR2A (0.52) | HTR2AGAABCL9CTNNB1MAPT | |
| SCHEMBL7080623 | 0.86 | HTR2A (0.53) | HTR2AGAABCL9CTNNB1MAPT | |
| SCHEMBL409084 | 0.84 | HTR2A (0.56) | HTR2AGAABCL9CTNNB1MAPT | |
| SCHEMBL4433836 | 0.84 | HTR2A (0.56) | HTR2AGAABCL9CTNNB1MAPT | |
| SCHEMBL125510 | 0.84 | HTR2A (0.56) | HTR2AGAABCL9CTNNB1MAPT | |
| SCHEMBL10062010 | 0.84 | HTR2A (0.56) | HTR2AGAABCL9CTNNB1MAPT | |
| SCHEMBL2615571 | 0.83 | HTR2A (0.48) | HTR2AGAABCL9CTNNB1MAPT | |
| SCHEMBL2597400 | 0.82 | BCL9 (0.63) | HTR2AGAABCL9CTNNB1MAPT |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3860999-A1 | DERIVATIVES OF RELEBACTAM AND USES THEREOF | Arixa Pharmaceuticals, Inc. (US) | 2021-08-11 | — | — | EP | disclosed |
| WO-2020072442-A1 | DERIVATIVES OF RELEBACTAM AND USES THEREOF | ARIXA PHARMACEUTICALS, INC. (US) | 2020-04-09 | — | — | WO | disclosed |
| WO-2001062242-A1 | PRODRUGS OF SUBSTITUTED CYCLOPENTANE AND CYCLOPENTENE COMPOUNDS USEFUL AS NEURAMINIDASE INHIBITORS | BIOCRYST PHARMACEUTICALS, INC. (US) | 2001-08-30 | — | — | WO | disclosed |
| US-5789595-A | ANTICOAGULANTS | TERUMO KABUSHIKI KAISHA (JP) | 1998-08-04 | — | — | US | disclosed |
| EP-0790247-A1 | TETRAHYDROISOQUINOLINE DERIVATIVE AND MEDICINAL PREPARATION CONTAINING THE SAME | TERUMO KABUSHIKI KAISHA (JP) | 1997-08-20 | — | — | EP | disclosed |