Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 5/20 | 0.32 |
| ▸ | HTR2B | P41595 | 5/20 | 0.32 |
| ▸ | HTR2A | P28223 | 4/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.32 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.32 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1099201 | 0.77 | HTR2C (0.46) | ALDH1A1L3MBTL1ACHEHTR2CHTR2B | |
| SCHEMBL6588410 | 0.76 | CYP2D6 (0.46) | ALDH1A1L3MBTL1MEN1HTTKMT2A | |
| SCHEMBL3977324 | 0.76 | CRBN (0.42) | ALDH1A1L3MBTL1MEN1KMT2ACRBN | |
| SCHEMBL22815698 | 0.73 | ADRA1D (0.40) | ALDH1A1L3MBTL1HTR2CHTR2BHTR2A | |
| SCHEMBL3973868 | 0.72 | HTR2A (0.47) | ALDH1A1L3MBTL1ACHEHTR2CHTR2B | |
| SCHEMBL6583602 | 0.71 | CA1 (0.42) | CA12CYP1A2CYP2C9KMT2AGABRG2 | |
| SCHEMBL6592294 | 0.71 | ACHE (0.51) | ACHEMEN1KMT2ADDB1CRBN | |
| SCHEMBL1099531 | 0.71 | CA1 (0.38) | CA12CA9ALDH1A1L3MBTL1ACHE | |
| Hydrochloric Acid SCHEMBL8483521 | 0.70 | CA1 (0.44) | CA12CYP1A2CYP2C9KMT2AGABRG2 | |
| SCHEMBL7281921 | 0.69 | L3MBTL1 (0.34) | ALDH1A1L3MBTL1HTR2CHTR2BHTR2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5968954-A | EXHIBIT SELECTIVE BINDING AFFINITY FOR 5-HYDROXYTRYPTAMINE RECEPTORS | ADIR ET COMPAGNIE (FR) | 1999-10-19 | — | — | US | disclosed |