Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.33 |
| ▸ | MLYCD | O95822 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | GFER | P55789 | 1/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | MMP12 | P39900 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL939950 | 0.83 | TDP1 (0.37) | TDP1ALDH1A1CYP3A4EPHX1EPHX2 | |
| Trifluoroacetic Acid SCHEMBL7418767 | 0.79 | PLG (0.43) | TDP1ALDH1A1CYP3A4EPHX1EPHX2 | |
| Trifluoroacetic Acid SCHEMBL939948 | 0.79 | PLG (0.43) | TDP1ALDH1A1CYP3A4EPHX1EPHX2 | |
| SCHEMBL31270861 | 0.78 | — | — | |
| SCHEMBL6256278 | 0.76 | HTT (0.31) | TDP1KMT2ASMN1; SMN2 | |
| SCHEMBL21813738 | 0.75 | TDP1 (0.44) | TDP1ALDH1A1CYP3A4EPHX1EPHX2 | |
| SCHEMBL940065 | 0.75 | PLG (0.52) | TDP1ALDH1A1CYP3A4EPHX1NPC1 | |
| SCHEMBL7430073 | 0.75 | PLG (0.52) | TDP1ALDH1A1CYP3A4EPHX1NPC1 | |
| SCHEMBL27514511 | 0.74 | MEN1 (0.30) | KMT2AMEN1 | |
| SCHEMBL775473 | 0.70 | CES2 (0.37) | TDP1ALDH1A1HDAC6KMT2AMEN1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101506185-B | Oxolane is [3,2-B] pyrroles-3-ketone intermediate also | 格兰泰有限公司 | 2016-06-29 | — | — | CN | disclosed |
| US-6958358-B2 | administering a cystatin; 4-tert-Butyl-N-[2-(4-hydroxyphenyl)-1S-(3-oxo-hexahydrocyclopenta[b]furan-3a-ylcarbamoyl)-ethyl]benzamide; bioassay for validation of efficacy ; Chagas' disease; parasiticide, trypanocide | AMURA THERAPEUTICS LIMITED (GB) | 2005-10-25 | — | — | US | disclosed |
| US-6245743-B1 | ADMINISTERING ARGININE-CONTAINING OLIGOPEPTIDE AS ANTICOAGULANT; CARDIOVASCULAR DISORDERS | COR THERAPEUTICS, INC. | 2001-06-12 | — | — | US | disclosed |
| US-6046169-A | Inhibitors of factor XA | COR THERAPEUTICS, INC. (US) | 2000-04-04 | — | — | US | disclosed |
| US-5919765-A | USING A (DI- OR TRI)PEPTIDES | COR THERAPEUTICS, INC. (US) | 1999-07-06 | — | — | US | disclosed |
| EP-0846125-A2 | INHIBITORS OF FACTOR Xa | COR THERAPEUTICS, INC. (US) | 1998-06-10 | — | — | EP | disclosed |
| US-5721214-A | PEPTIDE ANTICOAGULANTS | COR THERAPEUTICS, INC. (US) | 1998-02-24 | — | — | US | disclosed |