Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | POLB | P06746 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21000996 | 0.85 | TSHR (0.47) | TSHRTDP1CYP3A4ALDH1A1MAPT | |
| SCHEMBL15063757 | 0.80 | TSHR (0.46) | TSHRTDP1CYP3A4ALDH1A1MAPT | |
| SCHEMBL9848798 | 0.77 | TSHR (0.41) | TSHRTDP1CYP3A4ALDH1A1ALOX15 | |
| SCHEMBL15063896 | 0.76 | MAPT (0.43) | TSHRTDP1CYP3A4ALDH1A1MAPT | |
| SCHEMBL13836301 | 0.73 | TDP1 (0.46) | TSHRTDP1CYP3A4ALDH1A1MEN1 | |
| SCHEMBL6239786 | 0.73 | TSHR (0.46) | TSHRTDP1CYP3A4ALDH1A1GPR35 | |
| SCHEMBL596168 | 0.71 | MAPT (0.62) | TSHRTDP1CYP3A4ALDH1A1MAPT | |
| SCHEMBL19511923 | 0.71 | MAPT (0.62) | TSHRTDP1CYP3A4ALDH1A1MAPT | |
| SCHEMBL348272 | 0.71 | TSHR (0.59) | TSHRTDP1CYP3A4ALDH1A1MAPT | |
| SCHEMBL11219818 | 0.71 | TSHR (0.59) | TSHRTDP1CYP3A4ALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-115087655-A | Benzimidazole derivatives | 辉瑞公司 | 2022-09-20 | — | — | CN | disclosed |