Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | HTR7 | P34969 | 4/20 | 0.39 |
| ▸ | BCHE | P06276 | 2/20 | 0.39 |
| ▸ | ACHE | P22303 | 2/20 | 0.39 |
| ▸ | SOS1 | Q07889 | 2/20 | 0.38 |
| ▸ | EGFR | P00533 | 2/20 | 0.38 |
| ▸ | KRAS | P01116 | 1/20 | 0.38 |
| ▸ | LDHA | P00338 | 1/20 | 0.38 |
| ▸ | LDHB | P07195 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4376798 | 0.85 | ALDH1A1 (0.43) | ALDH1A1GAAPKMMAPTKMT2A | |
| SCHEMBL7018081 | 0.84 | ALDH1A1 (0.46) | ALDH1A1KMT2AHTR7MEN1ADRA1D | |
| SCHEMBL7007986 | 0.83 | HTR7 (0.43) | ALDH1A1HTR7SOS1EGFRKRAS | |
| SCHEMBL7007978 | 0.83 | HTR7 (0.45) | ALDH1A1HTR7LDHAADRA1DADRA1A | |
| SCHEMBL7007980 | 0.83 | HTR7 (0.45) | ALDH1A1HTR7LDHAADRA1DADRA1A | |
| SCHEMBL7009364 | 0.81 | HTR7 (0.49) | HTR7ADRA1DADRA1AADRA1B | |
| SCHEMBL7014065 | 0.79 | HTR7 (0.47) | KMT2AHTR7LDHAMEN1ADRA1D | |
| SCHEMBL7006322 | 0.77 | MAPK14 (0.44) | HTR7LDHAADRA1DADRA1AADRA1B | |
| SCHEMBL7006329 | 0.74 | F7 (0.44) | ALDH1A1MAPTKMT2AHTR7EGFR | |
| SCHEMBL4381740 | 0.73 | HTR7 (0.49) | ALDH1A1GAAPKMMAPTHTR7 |
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-1280781-A4 | 5-HT 7 RECEPTOR ANTAGONISTS | BRISTOL MYERS SQUIBB CO (US) | 2003-08-06 | — | — | EP | claimed |
| EP-1280781-A1 | 5-HT 7 RECEPTOR ANTAGONISTS | Bristol-Myers Squibb Company (US) | 2003-02-05 | — | — | EP | claimed |
| WO-2001085701-A1 | 5-HT7 RECEPTOR ANTAGONISTS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2001-11-15 | — | — | WO | claimed |