Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 5/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.38 |
| ▸ | HTR6 | P50406 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | ICMT | O60725 | 2/20 | 0.38 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | BCL2A1 | Q16548 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | TBXAS1 | P24557 | 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 | |
|---|---|---|---|---|
| SCHEMBL4317771 | 0.85 | HTR2C (0.52) | HTR2CCYP1A2HTR6CYP3A4TP53 | |
| SCHEMBL4315672 | 0.83 | ADRB1 (0.52) | HTR2CCYP1A2HTR6CYP3A4TP53 | |
| SCHEMBL4320202 | 0.81 | HTR2C (0.50) | HTR2CCYP1A2HTR6CYP3A4CYP2D6 | |
| SCHEMBL7476206 | 0.80 | ADRB1 (0.51) | HTR2CCYP1A2HTR6CYP3A4TP53 | |
| SCHEMBL2641322 | 0.79 | HTR2C (0.40) | HTR2CCYP1A2HTR6CYP3A4ADRB1 | |
| SCHEMBL7601597 | 0.78 | ADRB1 (0.47) | HTR2CCYP1A2HTR6CYP3A4TP53 | |
| SCHEMBL2640084 | 0.77 | CHRNB2 (0.49) | HTR2CCYP1A2HTR6CYP3A4TP53 | |
| SCHEMBL4308039 | 0.77 | TSHR (0.48) | HTR2CHTR6TSHRHSD17B10 | |
| SCHEMBL4316292 | 0.76 | SLC6A2 (0.47) | HTR2CHTR6ADRB1LMNACYP2C19 | |
| SCHEMBL4316373 | 0.75 | HTR2C (0.55) | HTR2CCYP1A2CYP3A4LMNAHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| JP-4831903-B2 | — | — | 2011-12-07 | — | — | JP | claimed |
| EP-1178973-A2 | NOVEL COMPOUNDS, THEIR USE AND PREPARATION | Pharmacia AB (SE) | 2002-02-13 | — | — | EP | claimed |
| WO-2000076984-A2 | NOVEL COMPOUNDS, THEIR USE AND PREPARATION | BIOVITRUM AB (SE) | 2000-12-21 | — | — | WO | claimed |