Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | PDK2 | Q15119 | 5/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 3/20 | 0.46 |
| ▸ | CA2 | P00918 | 3/20 | 0.46 |
| ▸ | CA7 | P43166 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA4 | P22748 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.44 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.44 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.43 |
| ▸ | APP | P05067 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL21880258 | 0.84 | PDK2 (0.54) | KMT2APDK2SIGMAR1 | |
| SCHEMBL14191206 | 0.79 | CA1 (0.50) | KMT2APDK2SIGMAR1CA1CA2 | |
| SCHEMBL18858207 | 0.77 | PDK2 (0.46) | KMT2APDK2TSHRALDH1A1HPGD | |
| SCHEMBL12802716 | 0.77 | KMT2A (0.49) | KMT2APDK2SIGMAR1CA1CA2 | |
| SCHEMBL7314812 | 0.77 | SCN9A (0.48) | KMT2APDK2CA1CA2CA7 | |
| SCHEMBL11041928 | 0.74 | KMT2A (0.71) | KMT2APDK2SIGMAR1CA1CA2 | |
| SCHEMBL30683762 | 0.74 | KMT2A (0.50) | KMT2APDK2SIGMAR1CA1CA2 | |
| SCHEMBL7315127 | 0.73 | PDK2 (0.51) | KMT2APDK2CA1CA2CA7 | |
| SCHEMBL10490946 | 0.73 | KMT2A (0.53) | KMT2APDK2SIGMAR1CA1CA2 | |
| SCHEMBL7313945 | 0.72 | PDK2 (0.46) | PDK2CA1CA2CA7CA9 |
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 |