Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 7/20 | 0.40 |
| ▸ | HTR2B | P41595 | 6/20 | 0.40 |
| ▸ | HTR2A | P28223 | 4/20 | 0.40 |
| ▸ | PARP1 | P09874 | 3/20 | 0.36 |
| ▸ | GPBAR1 | Q8TDU6 | 4/20 | 0.34 |
| ▸ | PARP2 | Q9UGN5 | 2/20 | 0.33 |
| ▸ | NSD3 | Q9BZ95 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8484580 | 0.72 | HTR2C (0.48) | HTR2CHTR2BHTR2AGPBAR1 | |
| SCHEMBL22605561 | 0.72 | GPBAR1 (0.50) | HTR2CHTR2BHTR2AGPBAR1 | |
| SCHEMBL11227084 | 0.67 | HTR2C (0.44) | HTR2CHTR2BHTR2APARP1 | |
| Trifluoroacetic Acid SCHEMBL22587774 | 0.66 | GPBAR1 (0.44) | HTR2CHTR2BHTR2AGPBAR1 | |
| Hydrochloric Acid SCHEMBL11030525 | 0.66 | HTR2C (0.43) | HTR2CHTR2BHTR2APARP1 | |
| SCHEMBL18175772 | 0.63 | HTR2C (0.53) | HTR2CHTR2BHTR2A | |
| SCHEMBL3279312 | 0.62 | PARP1 (0.49) | HTR2CHTR2BHTR2APARP1PARP2 | |
| SCHEMBL27988819 | 0.62 | GPBAR1 (0.54) | GPBAR1 | |
| SCHEMBL6270011 | 0.62 | HTR2C (0.55) | HTR2CHTR2BHTR2APARP1 | |
| SCHEMBL10811594 | 0.61 | TP53 (0.43) | HTR2CHTR2BHTR2AGPBAR1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1315490-A2 | A METHOD FOR TREATING ALLERGIES USING SUBSTITUTED PYRAZOLES | Ortho-McNeil Pharmaceutical, Inc. (US) | 2003-06-04 | — | — | EP | disclosed |
| EP-1309593-A2 | SUBSTITUTED PYRAZOLES | Ortho-McNeil Pharmaceutical, Inc. (US) | 2003-05-14 | — | — | EP | disclosed |
| WO-2002020011-A2 | A METHOD FOR TREATING ALLERGIES USING SUBSTITUTED PYRAZOLES | ORTHO MCNEIL PHARMACEUTICAL, INC. (US) | 2002-03-14 | — | — | WO | disclosed |
| WO-2002014315-A2 | SUBSTITUTED PYRAZOLES | ORTHO MCNEIL PHARMACEUTICAL, INC. (US) | 2002-02-21 | — | — | WO | disclosed |