Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 5/20 | 0.37 |
| ▸ | GAA | P10253 | 4/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.36 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.36 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | ALPL | P05186 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| O-Xylene SCHEMBL29074411 | 0.98 | TSHR (0.40) | TSHRACHEMAPTGAAPKM | |
| M-Xylene SCHEMBL29074382 | 0.80 | ACHE (0.46) | ACHEMAPTGAAPRSS1PRSS2 | |
| Fluorobenzene SCHEMBL28128810 | 0.80 | GAA (0.37) | MAPTGAAPKML3MBTL1ALDH1A1 | |
| Chlorobenzene SCHEMBL28129348 | 0.80 | TSHR (0.42) | TSHRMAPTGAAPKMALDH1A1 | |
| SCHEMBL350124 | 0.79 | — | — | |
| M-Xylene SCHEMBL29074417 | 0.79 | TAAR1 (0.45) | ACHEMAPTGAAPRSS1PRSS2 | |
| Chlorobenzene SCHEMBL28128879 | 0.79 | TSHR (0.41) | TSHRMAPTGAAPRSS1PRSS2 | |
| Fluorobenzene SCHEMBL28840059 | 0.79 | IDO1 (0.38) | MAPTGAAPKML3MBTL1PRSS1 | |
| O-Xylene SCHEMBL27995658 | 0.78 | TSHR (0.50) | TSHRACHEMAPTGAAPKM | |
| Anisole SCHEMBL27900059 | 0.77 | CA4 (0.50) | MAPTGAAPRSS1PRSS2PRSS3 |
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-111848494-B | Guanidine compounds and uses thereof | 伊谬诺米特医疗有限公司 | 2023-08-01 | — | — | CN | disclosed |