Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ACACB | O00763 | 3/20 | 0.38 |
| ▸ | ACACA | Q13085 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | RORC | P51449 | 1/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.35 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.35 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL24196888 | 0.99 | ALDH1A1 (0.42) | ALDH1A1TSHRALOX12CYP1A2CYP2D6 | |
| SCHEMBL24196890 | 0.94 | PTPN1 (0.37) | ALDH1A1TSHRALOX12CYP1A2CYP2D6 | |
| SCHEMBL24196882 | 0.77 | HAO1 (0.39) | ALDH1A1HTTLMNAMAPTRORC | |
| SCHEMBL24196873 | 0.73 | ALDH1A1 (0.36) | ALDH1A1CYP1A2CYP2D6CYP2C19ACACB | |
| SCHEMBL24904186 | 0.72 | HDAC3 (0.42) | ALDH1A1TSHRHTTLMNAMAPT | |
| SCHEMBL24196020 | 0.72 | PRMT6 (0.35) | MEN1KMT2A | |
| SCHEMBL24196886 | 0.71 | MAPT (0.35) | ALDH1A1TSHRLMNAMAPTMEN1 | |
| SCHEMBL24196867 | 0.71 | CTDSP1 (0.37) | ALDH1A1TSHRALOX12CYP2C19ACACB | |
| SCHEMBL8497080 | 0.71 | ALDH1A1 (0.71) | ALDH1A1TSHRALOX12CYP1A2CYP2D6 | |
| SCHEMBL26214110 | 0.70 | CA12 (0.55) | ALDH1A1TSHRCYP2C19HTTLMNA |
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-2022008475-A1 | INDOLE DERIVATIVES AND USES THEREOF FOR TREATING A CANCER | UNIVERSITE CLAUDE BERNARD LYON 1 (FR) | 2022-01-13 | — | — | WO | disclosed |