Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 6/20 | 0.65 |
| ▸ | METAP1 | P53582 | 4/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 3/20 | 0.40 |
| ▸ | HTR2A | P28223 | 3/20 | 0.40 |
| ▸ | HTR2C | P28335 | 3/20 | 0.40 |
| ▸ | HTR2B | P41595 | 3/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14157895 | 0.87 | ACHE (0.63) | ACHEMETAP1CYP19A1TSHRKDM4E | |
| SCHEMBL13391138 | 0.84 | ACHE (0.56) | ACHEMETAP1CYP19A1TSHRDRD2 | |
| SCHEMBL12998132 | 0.81 | ACHE (0.57) | ACHEMETAP1CYP19A1TSHRDRD2 | |
| SCHEMBL14328460 | 0.81 | ACHE (0.57) | ACHEMETAP1CYP19A1TSHRDRD2 | |
| Hydrochloric Acid SCHEMBL9592368 | 0.79 | ACHE (0.63) | ACHEMETAP1TSHRDRD2HTR2A | |
| SCHEMBL9592259 | 0.79 | ACHE (1.00) | ACHEMETAP1DRD2HTR2AHTR2C | |
| SCHEMBL11034810 | 0.77 | ACHE (0.56) | ACHEMETAP1TSHRHTR2AHTR2C | |
| SCHEMBL5369997 | 0.76 | ACHE (0.51) | ACHEMETAP1CYP19A1TSHRDRD2 | |
| SCHEMBL15144250 | 0.74 | ACHE (0.54) | ACHEMETAP1TSHRHTR2AHTR2C | |
| SCHEMBL11533307 | 0.74 | ACHE (0.50) | ACHEMETAP1TSHRDRD2HTR2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6300376-B1 | FOR THERAPY TO ACHIEVE SMOOTH MUSCLE RELAXING ACTIVITY AND/OR MAST CELL STABILIZING ACTIVITY AND/OR ANTI-INFLAMMATORY ACTIVITY | VENANTIUS LIMITED (IR) | 2001-10-09 | — | — | US | disclosed |