Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 3/20 | 0.40 |
| ▸ | HTR2B | P41595 | 3/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.38 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.37 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.37 |
| ▸ | HTR6 | P50406 | 2/20 | 0.35 |
| ▸ | PNMT | P11086 | 1/20 | 0.35 |
| ▸ | FNTA | P49354 | 1/20 | 0.35 |
| ▸ | FNTB | P49356 | 1/20 | 0.35 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.34 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.34 |
| ▸ | SOS1 | Q07889 | 3/20 | 0.34 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.33 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20140061 | 0.86 | HTR2C (0.40) | HTR2CHTR2BHTR2ANOTUMHTR6 | |
| Hydrochloric Acid SCHEMBL1583458 | 0.85 | OPRM1 (0.39) | HTR2CHTR2BHTR2AHTR6PNMT | |
| SCHEMBL7093297 | 0.81 | HTR2B (0.40) | HTR2CHTR2BHTR2AADRB1HTR6 | |
| SCHEMBL3658673 | 0.79 | P2RX7 (0.42) | HTR2CHTR2BHTR2AADRB1SOS1 | |
| SCHEMBL14896068 | 0.79 | AR (0.34) | NOTUM | |
| Hydrochloric Acid SCHEMBL27634037 | 0.76 | ADRB1 (0.61) | ADRB1HTR6SOS1HTR1A | |
| SCHEMBL31176347 | 0.75 | ADRB1 (0.54) | HTR2CHTR2BHTR2AADRB1DDB1 | |
| SCHEMBL3653056 | 0.75 | ADRB1 (0.54) | HTR2CHTR2BHTR2AADRB1DDB1 | |
| Hydrochloric Acid SCHEMBL5913602 | 0.74 | ADRB1 (0.53) | HTR2CHTR2BHTR2AADRB1DDB1 | |
| SCHEMBL18076473 | 0.74 | SLC6A2 (0.41) | HTR2CHTR2BHTR2APNMT |
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-1322643-A1 | PIPERAZIN-2-ONE AMIDES AS INHIBITORS OF FACTOR XA | Millennium Pharmaceuticals, Inc. (US) | 2003-07-02 | — | — | EP | disclosed |
| WO-2002026734-A1 | PIPERAZIN-2-ONE AMIDES AS INHIBITORS OF FACTOR Xa | COR THERAPEUTICS, INC. (US) | 2002-04-04 | — | — | WO | disclosed |