Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.39 |
| ▸ | CTSD | P07339 | 1/20 | 0.39 |
| ▸ | FUCA1 | P04066 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 4/20 | 0.37 |
| ▸ | S1PR3 | Q99500 | 4/20 | 0.37 |
| ▸ | S1PR2 | O95136 | 3/20 | 0.37 |
| ▸ | S1PR5 | Q9H228 | 3/20 | 0.37 |
| ▸ | FAAH | O00519 | 8/20 | 0.35 |
| ▸ | CES1 | P23141 | 6/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL27997235 | 1.00 | ALOX15 (0.50) | ALOX15EPHX1KDM4CCTSDFUCA1 | |
| Trifluoroacetic Acid SCHEMBL28782661 | 0.84 | ALOX15 (0.59) | ALOX15EPHX1S1PR1S1PR3S1PR2 | |
| Trifluoroacetic Acid SCHEMBL5344960 | 0.81 | PAOX (0.45) | EPHX1KDM4CFUCA1HDAC3HDAC1 | |
| Acetic Acid SCHEMBL27618733 | 0.80 | — | — | |
| Oxalic Acid SCHEMBL283076 | 0.80 | ALOX15 (0.73) | ALOX15EPHX1KDM4CCTSDHDAC3 | |
| Trifluoroacetic Acid SCHEMBL27176216 | 0.79 | EPHX1 (0.41) | EPHX1KDM4CFUCA1HDAC3HDAC1 | |
| Trifluoroacetic Acid SCHEMBL7105511 | 0.77 | CTSD (0.44) | ALOX15EPHX1KDM4CCTSDFUCA1 | |
| Trifluoroacetic Acid SCHEMBL15711042 | 0.77 | FAAH (0.46) | EPHX1FUCA1HDAC3HDAC1HDAC2 | |
| Trifluoroacetic Acid SCHEMBL8309485 | 0.76 | ALOX15 (0.43) | ALOX15EPHX1FUCA1S1PR1S1PR3 | |
| Trifluoroacetic Acid SCHEMBL906262 | 0.75 | FAAH (0.41) | EPHX1FAAHCES1CES2MEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0984977-A4 | METHOD FOR SINGLE-STEP ATTACHMENT OF A LABEL TO TARGET MOLECULES | MIRUS CORP (US) | 2002-07-31 | — | — | EP | disclosed |
| EP-0984977-A1 | METHOD FOR SINGLE-STEP ATTACHMENT OF A LABEL TO TARGET MOLECULES | Mirus Corporation (US) | 2000-03-15 | — | — | EP | disclosed |
| WO-1998052961-A1 | METHOD FOR SINGLE-STEP ATTACHMENT OF A LABEL TO TARGET MOLECULES | MIRUS CORPORATION (US) | 1998-11-26 | — | — | WO | disclosed |