Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 3/20 | 0.60 |
| ▸ | ALPI | P09923 | 1/20 | 0.56 |
| ▸ | PKM | P14618 | 1/20 | 0.56 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.56 |
| ▸ | XIAP | P98170 | 1/20 | 0.56 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.56 |
| ▸ | ANPEP | P15144 | 1/20 | 0.54 |
| ▸ | RNPEP | Q9H4A4 | 1/20 | 0.54 |
| ▸ | DNPEP | Q9ULA0 | 1/20 | 0.54 |
| ▸ | SLC15A1 | P46059 | 1/20 | 0.53 |
| ▸ | CTSC | P53634 | 1/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.52 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.52 |
| ▸ | MAOA | P21397 | 1/20 | 0.52 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.52 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.52 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.52 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.52 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.52 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL6013478 | 1.00 | MMP2 (0.60) | MMP2ALPIPKMPTGS1XIAP | |
| SCHEMBL24346075 | 0.90 | MMP2 (0.60) | MMP2ALPIPKMPTGS1XIAP | |
| SCHEMBL1041526 | 0.90 | MMP2 (0.60) | MMP2ALPIPKMPTGS1XIAP | |
| SCHEMBL9853256 | 0.90 | MMP2 (0.60) | MMP2ALPIPKMPTGS1XIAP | |
| Hydrochloric Acid SCHEMBL9556981 | 0.89 | MMP2 (0.58) | MMP2ALPIPKMPTGS1XIAP | |
| SCHEMBL3161775 | 0.88 | MMP2 (0.57) | MMP2ALPIPKMPTGS1XIAP | |
| SCHEMBL23641829 | 0.85 | MMP2 (0.61) | MMP2ALPIPKMPTGS1XIAP | |
| SCHEMBL5846333 | 0.84 | MMP2 (0.60) | MMP2ALPIPKMPTGS1XIAP | |
| SCHEMBL988104 | 0.83 | ALPI (0.59) | MMP2ALPIPKMPTGS1XIAP | |
| SCHEMBL6653906 | 0.83 | ALPI (0.59) | MMP2ALPIPKMPTGS1XIAP |
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-1545498-A4 | BACKBONE-SUBSTITUTED BIFUNCTIONAL DOTA LIGANDS, COMPLEXES AND COMPOSITIONS THEREOF, AND METHODS OF USING SAME | US GOV HEALTH & HUMAN SERV (US) | 2006-09-06 | — | — | EP | disclosed |
| EP-1545498-A2 | BACKBONE-SUBSTITUTED BIFUNCTIONAL DOTA LIGANDS, COMPLEXES AND COMPOSITIONS THEREOF, AND METHODS OF USING SAME | THE GOVERNMENT OF THE UNITED STATES OF AMERICA, as represented by THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2005-06-29 | — | — | EP | disclosed |
| WO-2004021996-A2 | BACKBONE-SUBSTITUTED BIFUNCTIONAL DOTA LIGANDS, COMPLEXES AND COMPOSITIONS THEREOF, AND METHODS OF USING SAME | THE GOVERNMENT OF THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES (US) | 2004-03-18 | — | — | WO | disclosed |