Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.54 |
| ▸ | MPO | P05164 | 3/20 | 0.54 |
| ▸ | HTR2C | P28335 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | HTR1A | P08908 | 3/20 | 0.52 |
| ▸ | HTR2A | P28223 | 2/20 | 0.52 |
| ▸ | HTR1D | P28221 | 2/20 | 0.52 |
| ▸ | HTR1B | P28222 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | NISCH | Q9Y2I1 | 6/20 | 0.46 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.45 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.45 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.45 |
| ▸ | HTR5A | P47898 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9828643 | 0.84 | HTR1D (0.59) | MPOHTR2CCYP2D6HTR1AHTR2A | |
| SCHEMBL9827561 | 0.84 | HTR1A (0.54) | MPOHTR2CCYP2D6KMT2AHTR1A | |
| SCHEMBL9827688 | 0.77 | HTR1D (0.50) | MPOHTR2CCYP2D6KMT2AHTR1A | |
| Hydrochloric Acid SCHEMBL10555707 | 0.76 | HTR1A (0.50) | MPOHTR2CCYP2D6KMT2AHTR1A | |
| SCHEMBL7330504 | 0.76 | KDM4E (0.66) | KDM4EMPOHTR2CMEN1CYP2D6 | |
| SCHEMBL1935161 | 0.74 | NISCH (0.69) | HTR1DLMNANISCH | |
| Hydrochloric Acid SCHEMBL2239536 | 0.72 | NISCH (0.68) | HTR1DLMNANISCH | |
| Hydrochloric Acid SCHEMBL15514269 | 0.72 | NISCH (0.68) | HTR1DLMNANISCH | |
| Hydrochloric Acid SCHEMBL1935805 | 0.72 | NISCH (0.68) | HTR1DLMNANISCH | |
| SCHEMBL4303662 | 0.72 | KDM4E (0.70) | KDM4EMPOHTR2CMEN1CYP2D6 |
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-0225726-B1 | INDOLE DERIVATIVES | GLAXO GROUP LIMITED (GB) | 1991-04-17 | — | — | EP | disclosed |
| US-4833153-A | VASOCONSTRICTORS, MIGRAINES | GLAXO GROUP LIMITED (GB) | 1989-05-23 | — | — | US | disclosed |
| EP-0225726-A1 | Indole derivatives | GLAXO GROUP LIMITED (GB) | 1987-06-16 | — | — | EP | disclosed |