Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 10/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7316883 | 0.71 | OPRM1 (0.41) | PDK2THRBTDP1ALDH1A1KMT2A | |
| SCHEMBL7316576 | 0.71 | CYP2D6 (0.41) | PDK2CHRM3THRBTDP1ALDH1A1 | |
| SCHEMBL7324797 | 0.70 | SLC1A3 (0.34) | CHRM3KMT2A | |
| SCHEMBL7313758 | 0.70 | THRB (0.43) | PDK2PTGS2THRBTDP1ALDH1A1 | |
| SCHEMBL7316356 | 0.69 | PDK2 (0.40) | PDK2CHRM3THRBTDP1ALDH1A1 | |
| SCHEMBL7316321 | 0.67 | THRB (0.39) | PDK2THRBTDP1LMNAKMT2A | |
| SCHEMBL27619850 | 0.66 | PDK2 (0.47) | PDK2THRBTDP1KMT2A | |
| SCHEMBL7319520 | 0.66 | PDK2 (0.44) | PDK2PTGS2 | |
| SCHEMBL7316444 | 0.63 | PDK2 (0.47) | PDK2PTGS2LMNAKMT2A | |
| SCHEMBL7819239 | 0.62 | MAPK1 (0.49) | PDK2CHRM3THRBTDP1ALDH1A1 |
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-6162824-A | NERVOUS SYSTEM DISORDERS; PSYCHOLOGICAL DISORDERS | ALLELIX NEUROSCIENCE INC. | 2000-12-19 | — | — | US | disclosed |