Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRHR1 | P34998 | 11/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | HRH1 | P35367 | 1/20 | 0.32 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL5518460 | 0.93 | CRHR1 (0.37) | CRHR1KDM4EALDH1A1MAPK1 | |
| Trifluoroacetic Acid SCHEMBL5039802 | 0.91 | CACNA1B (0.34) | CRHR1KCNH2KDM4E | |
| Trifluoroacetic Acid SCHEMBL5043695 | 0.90 | HTT (0.34) | CRHR1POLBMEN1KMT2AMAPK1 | |
| Trifluoroacetic Acid SCHEMBL5039148 | 0.89 | PKM (0.33) | CRHR1POLBMEN1KMT2ASMN1; SMN2 | |
| Trifluoroacetic Acid SCHEMBL5048861 | 0.88 | MAPT (0.34) | CRHR1POLBSMN1; SMN2 | |
| Trifluoroacetic Acid SCHEMBL5044836 | 0.88 | CRHR1 (0.36) | CRHR1 | |
| SCHEMBL5776271 | 0.83 | CRHR1 (0.44) | CRHR1 | |
| SCHEMBL5775346 | 0.82 | CRHR1 (0.33) | CRHR1KDM4EALDH1A1L3MBTL1 | |
| SCHEMBL5772870 | 0.81 | POLB (0.33) | CRHR1POLBKDM4EALDH1A1MAPK1 | |
| SCHEMBL5778787 | 0.80 | 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 1 patent. 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 |