Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1B | Q00975 | 2/20 | 0.34 |
| ▸ | CACNA1H | O95180 | 2/20 | 0.34 |
| ▸ | CRHR1 | P34998 | 4/20 | 0.33 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 4/20 | 0.32 |
| ▸ | FGFR4 | P22455 | 2/20 | 0.31 |
| ▸ | FASN | P49327 | 1/20 | 0.31 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5775346 | 0.92 | CRHR1 (0.33) | CRHR1NLRP3KDM1AKDM4E | |
| Trifluoroacetic Acid SCHEMBL5048824 | 0.91 | CRHR1 (0.40) | CRHR1KDM4EKCNH2 | |
| Trifluoroacetic Acid SCHEMBL5043695 | 0.87 | HTT (0.34) | CRHR1 | |
| Trifluoroacetic Acid SCHEMBL5039148 | 0.85 | PKM (0.33) | CRHR1 | |
| Trifluoroacetic Acid SCHEMBL5044836 | 0.84 | CRHR1 (0.36) | CRHR1 | |
| SCHEMBL5039215 | 0.83 | CRHR1 (0.35) | CRHR1KDM1A | |
| SCHEMBL5518460 | 0.83 | CRHR1 (0.37) | CRHR1KDM4E | |
| Trifluoroacetic Acid SCHEMBL5048861 | 0.83 | MAPT (0.34) | CRHR1 | |
| SCHEMBL5772870 | 0.79 | POLB (0.33) | CRHR1KDM4E | |
| SCHEMBL5778787 | 0.76 | CRHR1 (0.33) | CRHR1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-7432283-B2 | Heterocyclic GABAA subtype selective receptor modulators | ROCHE PALO ALTO LLC (US) | 2008-10-07 | — | — | US | disclosed |
| US-7268146-B2 | Ring fused pyrazole derivatives as CRF antagonists | PALO ALTO LLC (US) | 2007-09-11 | — | — | US | disclosed |
| US-7053103-B2 | Ring fused pyrazole derivatives as CRF antagonists | SYNTEX (U.S.A.) LLC (US) | 2006-05-30 | — | — | US | disclosed |