Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 3/20 | 0.56 |
| ▸ | HTR1A | P08908 | 4/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | MPO | P05164 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.56 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.56 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.56 |
| ▸ | HTR1D | P28221 | 1/20 | 0.56 |
| ▸ | HTR1B | P28222 | 1/20 | 0.56 |
| ▸ | HTR2A | P28223 | 1/20 | 0.56 |
| ▸ | HTR2C | P28335 | 1/20 | 0.56 |
| ▸ | HTR7 | P34969 | 1/20 | 0.56 |
| ▸ | CTSK | P43235 | 1/20 | 0.56 |
| ▸ | HTR6 | P50406 | 1/20 | 0.56 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.56 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL7845074 | 0.87 | HTR1A (0.74) | SLC6A4HTR1AKCNA5KCNH2 | |
| SCHEMBL7005718 | 0.82 | HTR2A (0.71) | SLC6A4HTR1ACYP3A4MPOCYP1A2 | |
| SCHEMBL7004146 | 0.82 | HTR2A (0.71) | SLC6A4HTR1ACYP3A4MPOCYP1A2 | |
| SCHEMBL8243669 | 0.82 | SLC6A4 (0.62) | SLC6A4HTR1ACYP3A4MPOCYP1A2 | |
| SCHEMBL16812539 | 0.81 | MEN1 (0.58) | HTR1ACYP3A4MPOCYP1A2CYP2D6 | |
| SCHEMBL7889427 | 0.81 | HTR2A (0.69) | SLC6A4HTR1ACYP3A4MPOCYP1A2 | |
| SCHEMBL7004071 | 0.81 | HTR2A (0.69) | SLC6A4HTR1ACYP3A4MPOCYP1A2 | |
| SCHEMBL7001306 | 0.81 | HTR2A (0.69) | SLC6A4HTR1ACYP3A4MPOCYP1A2 | |
| SCHEMBL16540689 | 0.81 | MCL1 (0.57) | SLC6A4CYP3A4CYP1A2CYP2D6SMN1; SMN2 | |
| SCHEMBL6714267 | 0.80 | SSTR2 (0.54) | HTR1ACYP3A4MPOCYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1415986-B1 | SPIRO ISOBENZOFURANES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS | BANYU PHARMA CO LTD (JP) | 2009-04-08 | — | — | EP | disclosed |
| US-7205417-B2 | Spiro compounds | BANYU PHARMACEUTICAL CO., LTD. (JP) | 2007-04-17 | — | — | US | disclosed |