Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 13/20 | 0.67 |
| ▸ | TMIGD3 | P0DMS9 | 2/20 | 0.59 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | RECQL | P46063 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL7687629 | 0.93 | ADORA3 (0.75) | ADORA3TMIGD3TRPV1KDM4ELMNA | |
| SCHEMBL7680777 | 0.80 | ADORA3 (1.00) | ADORA3TMIGD3TRPV1ALDH1A1CACNA1D | |
| SCHEMBL7689604 | 0.80 | ADORA3 (0.65) | ADORA3TMIGD3TRPV1KDM4ELMNA | |
| SCHEMBL1664685 | 0.79 | ADORA3 (0.71) | ADORA3TMIGD3TRPV1KDM4ELMNA | |
| SCHEMBL7383408 | 0.79 | ALDH1A1 (0.57) | ADORA3TMIGD3TRPV1KDM4EALDH1A1 | |
| SCHEMBL7383409 | 0.79 | ALDH1A1 (0.57) | ADORA3TMIGD3TRPV1KDM4EALDH1A1 | |
| SCHEMBL7685108 | 0.78 | ADORA3 (0.74) | ADORA3TMIGD3TRPV1KDM4EALDH1A1 | |
| SCHEMBL12648462 | 0.77 | ALDH1A1 (0.84) | ADORA3TRPV1KDM4ELMNAALDH1A1 | |
| SCHEMBL7687307 | 0.76 | ADORA3 (1.00) | ADORA3TMIGD3TRPV1ALDH1A1CACNA1D | |
| SCHEMBL8327248 | 0.76 | ADORA3 (0.68) | ADORA3TMIGD3TRPV1LMNAALDH1A1 |
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-6376521-B1 | ANTIINFLAMMATORY AGENTS; ANTIISCHEMIC AGENTS; CENTRAL NERVOUS SYSTEM DISORDERS | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES | 2002-04-23 | — | — | US | disclosed |
| WO-2000002861-A1 | A3 ADENOSINE RECEPTOR ANTAGONISTS | THE UNITED STATES OF AMERICA, REPRESENTED BY SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2000-01-20 | — | — | WO | disclosed |