Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.36 |
| ▸ | PDK2 | Q15119 | 3/20 | 0.34 |
| ▸ | CCR1 | P32246 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.33 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.33 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.33 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | KIF11 | P52732 | 1/20 | 0.32 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | STK17B | O94768 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL22048471 | 0.85 | CHRM3 (0.44) | CHRM3PDK2CCR1ALOX5P2RX1 | |
| SCHEMBL29722 | 0.84 | CHRM3 (0.46) | CHRM3SCN9ACCR1ALOX5P2RX1 | |
| SCHEMBL7322612 | 0.81 | CHRM3 (0.45) | CHRM3PDK2CCR1ALOX5OPRM1 | |
| SCHEMBL9700918 | 0.80 | CHRM3 (0.41) | CHRM3PDK2CCR1ALOX5P2RX1 | |
| SCHEMBL22048472 | 0.79 | CHRM3 (0.40) | CHRM3CCR1ALOX5P2RX1P2RX3 | |
| SCHEMBL7313184 | 0.79 | PDK2 (0.49) | PDK2OPRK1KIF11 | |
| SCHEMBL21645761 | 0.77 | GAA (0.49) | CHRM3PDK2ALOX5P2RX4 | |
| SCHEMBL30825751 | 0.77 | CHRM3 (0.46) | CHRM3SCN9APDK2OPRM1OPRD1 | |
| SCHEMBL5583991 | 0.77 | CHRM3 (0.46) | CHRM3SCN9APDK2OPRM1OPRD1 | |
| SCHEMBL22169938 | 0.73 | KDM4E (0.44) | CHRM3CCR1P2RX1P2RX3P2RX4 |
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 |
|---|---|---|---|---|---|---|---|
| US-6162824-A | NERVOUS SYSTEM DISORDERS; PSYCHOLOGICAL DISORDERS | ALLELIX NEUROSCIENCE INC. | 2000-12-19 | — | — | US | disclosed |
| WO-1999041227-A1 | TRICYCLIC COMPOUNDS AS GLYCINE TRANSPORT INHIBITORS | ALLELIX NEUROSCIENCE, INC. (US) | 1999-08-19 | — | — | WO | disclosed |