Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | MMP2 | P08253 | 2/20 | 0.31 |
| ▸ | MMP9 | P14780 | 1/20 | 0.31 |
| ▸ | MMP14 | P50281 | 1/20 | 0.31 |
| ▸ | CTSL | P07711 | 1/20 | 0.31 |
| ▸ | CTSB | P07858 | 1/20 | 0.31 |
| ▸ | CTSS | P25774 | 1/20 | 0.31 |
| ▸ | CTSK | P43235 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5189110 | 0.99 | LMNA (0.32) | LMNAUSP2CRBNTP53HTR2A | |
| SCHEMBL1122123 | 0.78 | CYP3A4 (0.43) | USP2MAPTPKM | |
| SCHEMBL5189063 | 0.76 | MMP2 (0.40) | LMNAUSP2CRBNTP53HTR2A | |
| SCHEMBL5827168 | 0.68 | ALDH1A1 (0.48) | USP2HTR2AHTR2CCA1CA2 | |
| Hydrochloric Acid SCHEMBL1121811 | 0.67 | ALDH1A1 (0.47) | USP2HTR2AHTR2CMAPTPKM | |
| SCHEMBL17101994 | 0.66 | PKM (0.48) | USP2PKM | |
| Hydrochloric Acid SCHEMBL5787327 | 0.65 | AOC2 (0.34) | HTR2AHTR2CMAPT | |
| SCHEMBL3244612 | 0.64 | SLC6A2 (0.45) | — | |
| Hydrochloric Acid SCHEMBL3997950 | 0.63 | SLC6A2 (0.44) | — | |
| Hydrochloric Acid SCHEMBL3252467 | 0.63 | SLC6A2 (0.44) | — |
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-2005047247-A1 | NOVEL1,3-DISUBSTITUTED AZETIDINE DERIVATIVES FOR USE AS 5HT2A RECEPTOR LIGANDS | MERCK SHARP & DOHME LIMITED (GB) | 2005-05-26 | — | — | WO | claimed |