Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR2 | O43614 | 1/20 | 0.39 |
| ▸ | TACR1 | P25103 | 4/20 | 0.38 |
| ▸ | TRPV1 | Q8NER1 | 8/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TRIM24 | O15164 | 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 | |
|---|---|---|---|---|
| SCHEMBL6607716 | 1.00 | HCRTR2 (0.39) | HCRTR2TACR1TRPV1KDM1AMEN1 | |
| SCHEMBL7828679 | 0.94 | HCRTR2 (0.39) | HCRTR2TACR1TRPV1KDM1AMEN1 | |
| SCHEMBL6604442 | 0.94 | HCRTR2 (0.39) | HCRTR2TACR1TRPV1KDM1AMEN1 | |
| SCHEMBL6606866 | 0.89 | TACR1 (0.45) | HCRTR2TACR1TRPV1KDM1ATRIM24 | |
| SCHEMBL8664244 | 0.89 | TACR1 (0.45) | HCRTR2TACR1TRPV1KDM1ATRIM24 | |
| SCHEMBL6605255 | 0.89 | HCRTR2 (0.39) | HCRTR2TACR1TRPV1KDM1AMEN1 | |
| SCHEMBL7030644 | 0.88 | TACR1 (0.44) | HCRTR2TACR1KDM1AMEN1KMT2A | |
| SCHEMBL6606522 | 0.88 | TACR1 (0.44) | HCRTR2TACR1KDM1AMEN1KMT2A | |
| SCHEMBL6603330 | 0.85 | TACR1 (0.43) | HCRTR2TACR1KDM1A | |
| SCHEMBL7026966 | 0.84 | TACR1 (0.44) | HCRTR2TACR1KDM1AMEN1KMT2A |
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-0840732-A1 | SUBSTITUTED BENZOLACTAM COMPOUNDS AS SUBSTANCE P ANTAGONISTS | PFIZER INC. (US) | 1998-05-13 | — | — | EP | disclosed |
| WO-1997003066-A1 | SUBSTITUTED BENZOLACTAM COMPOUNDS AS SUBSTANCE P ANTAGONISTS | PFIZER PHARMACEUTICALS INC. (JP) | 1997-01-30 | — | — | WO | disclosed |