Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | GMNN | O75496 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | MMP9 | P14780 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | MMP8 | P22894 | 1/20 | 0.34 |
| ▸ | CCR1 | P32246 | 1/20 | 0.34 |
| ▸ | THPO | P40225 | 1/20 | 0.34 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL13845114 | 0.81 | TDP1 (0.37) | TDP1KDM4EGMNNLMNATP53 | |
| SCHEMBL1404621 | 0.78 | GRM5 (0.48) | TDP1NFKB1SMN1; SMN2P2RX7TDP2 | |
| SCHEMBL618831 | 0.72 | — | — | |
| SCHEMBL4070563 | 0.70 | PIK3CA (0.37) | TDP1LMNAHTTSMN1; SMN2TDP2 | |
| SCHEMBL13845088 | 0.68 | CYP19A1 (0.36) | TDP1KDM4EGMNNLMNATP53 | |
| SCHEMBL30667190 | 0.68 | CYP19A1 (0.36) | TDP1KDM4EGMNNLMNATP53 | |
| SCHEMBL5173946 | 0.68 | ITGB2 (0.48) | LMNATSHRHTTSMN1; SMN2MEN1 | |
| SCHEMBL10370596 | 0.68 | GRM5 (0.33) | ACHETDP1KDM4EGMNNLMNA | |
| SCHEMBL3063384 | 0.68 | FABP6 (0.44) | TDP1SMN1; SMN2TDP2NSD2ABL1 | |
| SCHEMBL31627399 | 0.66 | AKT1 (0.33) | ACHEPDE1APDE1BPDE1CPIK3CA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022204150-A1 | COMPOUNDS AND COMPOSITIONS FOR TREATING CNS DISORDERS | BLUE OAK PHARMACEUTICALS, INC. (US) | 2022-09-29 | — | — | WO | disclosed |