Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRHR1 | P34998 | 3/20 | 0.40 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.35 |
| ▸ | BRD7 | Q9NPI1 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.35 |
| ▸ | CASP3 | P42574 | 4/20 | 0.32 |
| ▸ | CASP7 | P55210 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5728223 | 1.00 | CRHR1 (0.40) | CRHR1BRD9BRD7ADORA2AADORA1 | |
| SCHEMBL5724194 | 0.91 | CRHR1 (0.40) | CRHR1BRD9BRD7ADORA2AADORA1 | |
| SCHEMBL5724470 | 0.89 | CRHR1 (0.35) | CRHR1BRD9BRD7ADORA2AADORA1 | |
| SCHEMBL5724157 | 0.85 | CRHR1 (0.40) | CRHR1ADORA2AADORA1CASP3CASP7 | |
| SCHEMBL5724921 | 0.83 | CRHR1 (0.41) | CRHR1ADORA2AADORA1 | |
| SCHEMBL5724293 | 0.83 | CRHR1 (0.37) | CRHR1ADORA2AADORA1 | |
| SCHEMBL5726428 | 0.81 | CRHR1 (0.34) | CRHR1ADORA2AADORA1CASP3CASP7 | |
| SCHEMBL5724242 | 0.80 | TACR1 (0.36) | CRHR1ADORA2AADORA1CASP3CASP7 | |
| SCHEMBL5724697 | 0.79 | TACR1 (0.42) | CRHR1ADORA2AADORA1 | |
| SCHEMBL6491687 | 0.78 | TACR1 (0.36) | CRHR1ADORA2AADORA1CASP3CASP7 |
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-1620428-A1 | SUBSTITUTED PYRIMIDINONES AND PYRIMIDINTHIONES AS CRF ANTAGONISTS | Pharmacia & Upjohn Company LLC (US) | 2006-02-01 | — | — | EP | claimed |
| WO-2004094408-A1 | SUBSTITUTED PYRIMIDINONES AND PYRIMIDINTHIONES AS CRF ANTAGONISTS | PHARMACIA & UPJOHN COMPANY LLC (US) | 2004-11-04 | — | — | WO | claimed |