Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRSS1 | P07477 | 1/20 | 0.42 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.42 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | MTNR1A | P48039 | 4/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.38 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.36 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.36 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8397401 | 0.80 | SIGMAR1 (0.54) | MEN1KMT2A | |
| SCHEMBL9627587 | 0.79 | SIGMAR1 (0.42) | KMT2ACYP1A2CYP3A4AOC3SLC6A2 | |
| SCHEMBL8400924 | 0.79 | HTR2C (0.37) | SLC6A2SLC6A4HTR3EHTR3BHTR3A | |
| Bicarbonate SCHEMBL8495157 | 0.76 | PARP1 (0.50) | PRSS1PRSS2PRSS3MEN1KMT2A | |
| SCHEMBL8332522 | 0.75 | ACHE (0.53) | PRSS1PRSS2PRSS3CYP3A4MTNR1A | |
| SCHEMBL9626664 | 0.72 | SIGMAR1 (0.54) | CYP1A2CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL8334067 | 0.71 | SIGMAR1 (0.37) | CYP1A2CYP3A4SLC6A2 | |
| SCHEMBL28382188 | 0.70 | PARP1 (0.56) | PRSS1PRSS2PRSS3L3MBTL1MTNR1A | |
| SCHEMBL15779182 | 0.69 | MTNR1A (0.46) | L3MBTL1MTNR1AMTNR1BHSD17B1HSD17B2 | |
| SCHEMBL27587717 | 0.69 | MTNR1A (0.46) | L3MBTL1CYP1A2CYP3A4CYP2C19MTNR1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-1999002145-A1 | COMBINATION DRUG THERAPIES COMPRISING AMINOGLYCOSIDE ANTIBIOTICS AND N,N'-DISUBSTITUTED GUANIDINES | CAMBRIDGE NEUROSCIENCE, INC. (US) | 1999-01-21 | — | — | WO | claimed |