Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 9/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.37 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.37 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | PRCP | P42785 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL7316176 | 0.86 | PDK2 (0.50) | PDK2TDP1ALDH1A1MEN1KMT2A | |
| SCHEMBL7320725 | 0.84 | PDK2 (0.51) | PDK2 | |
| SCHEMBL7323011 | 0.82 | PDK2 (0.53) | PDK2MEN1KMT2A | |
| SCHEMBL7322740 | 0.82 | PDK2 (0.53) | PDK2TDP1HSP90AA1ALDH1A1MEN1 | |
| SCHEMBL7315243 | 0.82 | PDK2 (0.41) | PDK2ALDH1A1 | |
| SCHEMBL7315587 | 0.81 | KDM4E (0.36) | PDK2OPRM1OPRL1OPRD1OPRK1 | |
| SCHEMBL7319059 | 0.79 | CHRM2 (0.42) | OPRM1OPRL1OPRD1OPRK1CHRM2 | |
| SCHEMBL27755004 | 0.73 | MEN1 (0.44) | PDK2THRBTDP1OPRM1OPRL1 | |
| SCHEMBL21880270 | 0.72 | PDK2 (0.41) | PDK2THRBTDP1HSP90AA1HSP90AB1 | |
| SCHEMBL7555085 | 0.72 | CHRM2 (0.37) | OPRM1OPRL1OPRD1OPRK1CHRM2 |
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 |