Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.33 |
| ▸ | DRD1 | P21728 | 4/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | CTSD | P07339 | 3/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8969818 | 0.80 | PDE10A (0.33) | PARP1PDE10ADRD1HTR1A | |
| SCHEMBL8968749 | 0.78 | CTSD (0.38) | PARP1DRD1ACHECTSD | |
| SCHEMBL8968644 | 0.75 | DRD1 (0.33) | PARP1DRD1HTR1AACHE | |
| SCHEMBL8969723 | 0.69 | HTR2C (0.36) | HTR2CHTR2B | |
| SCHEMBL8969213 | 0.66 | ACHE (0.40) | HTR2CHTR2BACHECTSD | |
| SCHEMBL8970250 | 0.65 | HTR2C (0.32) | HTR2CHTR2B | |
| SCHEMBL8968500 | 0.64 | NOS1 (0.35) | — | |
| SCHEMBL8968350 | 0.64 | — | — | |
| SCHEMBL8968239 | 0.64 | — | — | |
| SCHEMBL8969145 | 0.63 | — | — |
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-5486512-A | LEARNING ENHANCEMENT | WARNER-LAMBERT COMPANY (US) | 1996-01-23 | — | — | US | disclosed |
| WO-1993003034-A1 | QUINAZOLINE DERIVATIVES AS ACETYLCHOLINESTERASE INHIBITORS | WARNER-LAMBERT COMPANY (US) | 1993-02-18 | — | — | WO | disclosed |